SCHEMBL4854841

SCHEMBL4854841

Cc1cc(C)c(/N=C/C=N/c2c(C)cc(C)cc2C)c(C)c1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 4/20 0.38
ALDH1A1 P00352 4/20 0.36
CYP3A4 P08684 1/20 0.34
ADRA2A P08913 1/20 0.34
KDM4E B2RXH2 2/20 0.32
LMNA P02545 2/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2A6 P11509 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TSHR P16473 1/20 0.30
F2 P00734 1/20 0.30
PRSS1 P07477 1/20 0.30
PRSS2 P07478 1/20 0.30
PRSS3 P35030 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14457987 1.00 RAPGEF4 (0.38) RAPGEF4ALDH1A1CYP3A4ADRA2AKDM4E
SCHEMBL13987030 1.00 RAPGEF4 (0.38) RAPGEF4ALDH1A1CYP3A4ADRA2AKDM4E
SCHEMBL4854848 1.00 RAPGEF4 (0.38) RAPGEF4ALDH1A1CYP3A4ADRA2AKDM4E
SCHEMBL29395663 0.81 RAPGEF4 (0.36) RAPGEF4ALDH1A1CYP3A4ADRA2AKDM4E
SCHEMBL17669763 0.79 RAPGEF4 (0.35) RAPGEF4ALDH1A1CYP3A4ADRA2AKDM4E
SCHEMBL21860490 0.77
SCHEMBL23644548 0.77 KMT2A (0.33) RAPGEF4ALDH1A1GAAKMT2A
SCHEMBL23644547 0.77 KMT2A (0.33) RAPGEF4ALDH1A1GAAKMT2A
SCHEMBL11856863 0.75 RAPGEF4 (0.37) RAPGEF4ALDH1A1CYP3A4ADRA2A
SCHEMBL11281680 0.75 CYP3A4 (0.57) RAPGEF4ALDH1A1CYP3A4ADRA2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 39 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250244419-A1 INFUSION DEVICE FOR THE PREPARATION AND DELIVERY OF MRI PROBES THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVIC (US) 2025-07-31 US disclosed
US-20250242340-A1 SABRE CATALYSTS CONTAINING FLUORINATED CARBON CHAINS FOR DELIVERY OF METAL-FREE MRI CONTRAST AGENTS THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVIC (US) 2025-07-31 US disclosed
EP-4505201-A1 INFUSION DEVICE FOR THE PREPARATION AND DELIVERY OF MRI PROBES The United States of America, as represented by the Secretary, Department of Health and Human Services (US) 2025-02-12 EP disclosed
EP-4504404-A2 SABRE CATALYSTS CONTAINING FLUORINATED CARBON CHAINS FOR DELIVERY OF METAL-FREE MRI CONTRAST AGENTS The United States of America, as represented by the Secretary, Department of Health and Human Services (US) 2025-02-12 EP disclosed
US-20240216900-A1 SABRE CATALYSTS CONTAINING FLUORINATED CARBON CHAINS FOR DELIVERY OF METAL-FREE MRI CONTRAST AGENTS THE U.S.A., AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2024-07-04 US disclosed
WO-2023196602-A1 INFUSION DEVICE FOR THE PREPARATION AND DELIVERY OF MRI PROBES THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2023-10-12 WO disclosed
WO-2023196594-A2 SABRE CATALYSTS CONTAINING FLUORINATED CARBON CHAINS FOR DELIVERY OF METAL-FREE MRI CONTRAST AGENTS THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2023-10-12 WO disclosed
EP-3394121-B1 PROCESS FOR THE PREPARATION OF (CO) POLYMERS OF CONJUGATED DIENES IN THE PRESENCE OF A CATALYTIC SYSTEM COMPRISING A VANADIUM BIS-IMINE COMPLEX VERSALIS SPA (IT) 2023-06-07 EP disclosed
US-20220152208-A1 NON-IONIC BLOCK COPOLYMERS AND PHARMACEUTICAL COMPOSITIONS DERIVED THEREFROM Altus Formulation Inc. (CA) 2022-05-19 US disclosed
US-11299505-B2 Bis-imine titanium complex, catalytic system comprising said bis-imine titanium complex and process for the (co)polymertzation of conjugated dienes VERSALIS S.P.A. (IT) 2022-04-12 US disclosed
US-20140228206-A1 BIS-IMINE COMPLEX OF LANTHANIDES, CATALYTIC SYSTEM COMPRISING SAID BIS-IMINE COMPLEX AND PROCESS FOR THE (CO)POLYMERIZATION OF CONJUGATED DIENES VERSALIS S.P.A. (IT) 2014-08-14 US disclosed
US-20140228206-A1 BIS-IMINE COMPLEX OF LANTHANIDES, CATALYTIC SYSTEM COMPRISING SAID BIS-IMINE COMPLEX AND PROCESS FOR THE (CO)POLYMERIZATION OF CONJUGATED DIENES VERSALIS S.P.A. (IT) 2014-08-14 US disclosed
US-20130261312-A1 SUPPORTED OLEFIN METATHESIS CATALYSTS MATERIA, INC. (US) 2013-10-03 US disclosed
US-20130261312-A1 SUPPORTED OLEFIN METATHESIS CATALYSTS MATERIA, INC. (US) 2013-10-03 US disclosed
WO-2013037910-A1 BIS-IMINE COMPLEX OF LANTHANIDES, CATALYTIC SYSTEM COMPRISING SAID BIS-IMINE COMPLEX AND PROCESS FOR THE (CO)POLYMERIZATION OF CONJUGATED DIENES VERSALIS S.P.A. (IT) 2013-03-21 WO disclosed
US-8263774-B2 Quinoline-oxazoline compounds and their use in oxidation synthesis UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2012-09-11 US disclosed
WO-2011069134-A2 SUPPORTED OLEFIN METATHESIS CATALYSTS MATERIA, INC. (US) 2011-06-09 WO disclosed
US-20110054176-A1 QUINOLINE-OXAZOLINE COMPOUNDS AND THEIR USE IN OXIDATION SYNTHESIS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2011-03-03 US disclosed
US-7470750-B2 Method for the degradation of nitrile rubber by metathesis in the presence of ruthenium- or osmium-based catalysts LANXESS DEUTSCHLAND GMBH (DE) 2008-12-30 US disclosed
US-20070049700-A1 Method for the degradation of nitrile rubber by metathesis in the presence of ruthenium- or osmium-based catalysts LANXESS DEUTSCHLAND GMBH (DE) 2007-03-01 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20250244419-A1 INFUSION DEVICE FOR THE PREPARATION AND DELIVERY OF MRI PROBES MPI, HAMP, HIF1A RAPGEF4 1420/4885ALDH1A1 3474/4885CYP3A4 1446/4885
US-20110054176-A1 QUINOLINE-OXAZOLINE COMPOUNDS AND THEIR USE IN OXIDATION SYNTHESIS XDH, OXA1L, AOX1 RAPGEF4 3992/4885ALDH1A1 421/4885CYP3A4 128/4885
US-20240216900-A1 SABRE CATALYSTS CONTAINING FLUORINATED CARBON CHAINS FOR DELIVERY OF METAL-FREE MRI CONTRAST AGENTS FABP7, FFAR1, FABP1 RAPGEF4 4067/4885ALDH1A1 4484/4885CYP3A4 4655/4885
US-20220152208-A1 NON-IONIC BLOCK COPOLYMERS AND PHARMACEUTICAL COMPOSITIONS DERIVED THEREFROM F11, F13B, F10 RAPGEF4 1288/4885ALDH1A1 1912/4885CYP3A4 210/4885
US-20250242340-A1 SABRE CATALYSTS CONTAINING FLUORINATED CARBON CHAINS FOR DELIVERY OF METAL-FREE MRI CONTRAST AGENTS FABP7, FFAR1, FABP1 RAPGEF4 4067/4885ALDH1A1 4484/4885CYP3A4 4655/4885
US-11299505-B2 Bis-imine titanium complex, catalytic system comprising said bis-imine titanium complex and process for the (co)polymertzation of conjugated dienes AOC2, AOC1, AOC3 RAPGEF4 2575/4885ALDH1A1 1005/4885CYP3A4 155/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.