SCHEMBL283987

SCHEMBL283987

Cc1cc(C)c(N2[C]N(c3c(C)cc(C)cc3C)CC2)c(C)c1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HRH3 Q9Y5N1 3/20 0.35
KDM4E B2RXH2 1/20 0.33
RAPGEF4 Q8WZA2 1/20 0.33
GAA P10253 1/20 0.31
MEN1 O00255 1/20 0.30
MAPK1 P28482 1/20 0.30
KMT2A Q03164 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
SCHEMBL6099464 0.91 POLB (0.40) ALDH1A1NPSR1POLBMAPTHTT
SCHEMBL17502571 0.82 L3MBTL1 (0.32) MAPT
SCHEMBL17502575 0.82 P2RX7 (0.33)
SCHEMBL17502583 0.82 RAPGEF4 (0.31) RAPGEF4
SCHEMBL19206406 0.81 TSHR (0.34) ALDH1A1
SCHEMBL1243406 0.77 ALDH1A1 (0.35) ALDH1A1NPSR1POLBMAPTHTT
SCHEMBL623217 0.76 ALDH1A1 (0.38) ALDH1A1POLBMAPTHTTKDM4E
SCHEMBL19206354 0.75 ALDH1A1 (0.30) ALDH1A1POLB
SCHEMBL19030908 0.74 CYP2D6 (0.41) ALDH1A1NPSR1MAPTHTTKDM4E
SCHEMBL3918315 0.73 ALDH1A1 (0.33) ALDH1A1NPSR1POLBMAPTHTT

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 1115 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3016991-B1 LIQUID MOLDING COMPOSITIONS MATERIA INC (US) 2024-06-12 EP claimed
EP-4139281-B1 SULFUR EXTRUSION FROM DISULFIDES BY CARBENES UNIV HEIDELBERG (DE) 2024-05-08 EP claimed
US-20240116039-A1 RUTHENIUM-BASED METATHESIS CATALYSTS, PRECURSORS FOR THEIR PREPARATION AND THEIR USE UMICORE AG & CO. KG (DE) 2024-04-11 US claimed
EP-4288479-A1 LONG SHELF LIFE STABLE PHOTOACTIVE MASS POLYMERIZABLE POLYCYCLOOLEFIN COMPOSITIONS AS OPTICAL MATERIALS Promerus, LLC (US) 2023-12-13 EP claimed
EP-3256505-B1 CYCLIC OLEFIN RESIN COMPOSITIONS COMPRISING FUNCTIONAL ELASTOMERS MATERIA INC (US) 2023-11-29 EP claimed
US-11821112-B1 Polymer fibers and particles produced by electrospinning or electrospraying SCALE HOLDINGS LLC (US) 2023-11-21 US claimed
US-20230149911-A1 RUTHENIUM-BASED METATHESIS CATALYSTS, PRECURSORS FOR THEIR PREPARATION AND THEIR USE UMICORE AG & CO. KG (DE) 2023-05-18 US claimed
US-20230151054-A1 SULFUR EXTRUSION FROM DISULFIDES BY CARBENES Universität Heidelberg (DE) 2023-05-18 US claimed
US-11577232-B2 Ruthenium-based metathesis catalysts, precursors for their preparation and their use UMICORE AG & CO. KG (DE) 2023-02-14 US claimed
US-20220204465-A1 PROCESS FOR THE CARBONYLATION OF EPOXIDES COVESTRO INTELLECTUAL PROPERTY GMBH & CO. KG (DE) 2022-06-30 US claimed
EP-1704172-A1 LINEAR FUNCTIONAL COPOLYMERS OF ETHYLENE WITH PRECISE AND MINIMUM RUN LENGTH DISTRIBUTIONS AND METHODS OF MAKING THEREOF ExxonMobil Research and Engineering Company (US) 2006-09-27 EP claimed
US-20060128935-A1 Manufacture of macrocyclic polyester oligomers E. I. DU PONT DE NEMOURS AND COMPANY 2006-06-15 US claimed
US-20060128912-A1 Transition metal carbene complexes containing a cationic substituent as catalysts of olefin metathesis reactions UTI LIMITED PARTNERSHIP (CA) 2006-06-15 US claimed
US-20060122398-A1 Novel nickel-carbene, palladium-carbene and platinum-carbene complexes, their produciton and use in catalytic reactions UMICORE AG & CO. KG (DE) 2006-06-08 US claimed
US-7002049-B2 Process for α,β-dihydroxyalkenes and derivatives EASTMAN CHEMICAL COMPANY (US) 2006-02-21 US claimed
US-20060030742-A1 Process for alpha,beta-dihydroxyalkenes and derivatives HEMBRE ROBERT T 2006-02-09 US claimed
WO-2005121158-A1 TRANSITION METAL CARBENE COMPLEXES CONTAINING A CATIONIC SUBSTITUENT AS CATALYSTS OF OLEFIN METATHESIS REACTIONS UNIVERSITY TECHNOLOGIES INTERNATIONAL INC. (CA) 2005-12-22 WO claimed
WO-2005063834-A1 LINEAR FUNCTIONAL COPOLYMERS OF ETHYLENE WITH PRECISE AND MINIMUM RUN LENGTH DISTRIBUTIONS AND METHODS OF MAKING THEREOF EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2005-07-14 WO claimed
US-20050137369-A1 Linear functional copolymers of ethylene with precise and minimum run length distributions and method of making thereof EXXONMOBIL RESEARCH AND ENGINEERING COMPANY 2005-06-23 US claimed
US-20040044229-A1 Process for alpha,beta-dihydroxyalkenes and derivatives HEMBRE ROBERT THOMAS (US) 2004-03-04 US claimed

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

For each of this compound's patents that has machine-readable text (9 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-20040044229-A1 Process for alpha,beta-dihydroxyalkenes and derivatives CYP8B1, EBP, DEGS1 ALDH1A1 226/4885NPSR1 2074/4885POLB 550/4885
US-20060128912-A1 Transition metal carbene complexes containing a cationic substituent as catalysts of olefin metathesis reactions SOD1, OPRM1, C1S ALDH1A1 3136/4885NPSR1 2641/4885POLB 2129/4885
US-20060030742-A1 Process for alpha,beta-dihydroxyalkenes and derivatives CYP8B1, EBP, DHCR24 ALDH1A1 195/4885NPSR1 2175/4885POLB 490/4885
US-20230149911-A1 RUTHENIUM-BASED METATHESIS CATALYSTS, PRECURSORS FOR THEIR PREPARATION AND THEIR USE HMBS, RRP12, RNF168 ALDH1A1 844/4885NPSR1 4751/4885POLB 56/4885
US-11577232-B2 Ruthenium-based metathesis catalysts, precursors for their preparation and their use HMBS, RRP12, RNF168 ALDH1A1 844/4885NPSR1 4751/4885POLB 56/4885
US-20240116039-A1 RUTHENIUM-BASED METATHESIS CATALYSTS, PRECURSORS FOR THEIR PREPARATION AND THEIR USE HMBS, RRP12, RNF168 ALDH1A1 844/4885NPSR1 4751/4885POLB 56/4885
US-20220204465-A1 PROCESS FOR THE CARBONYLATION OF EPOXIDES CBR1, CBR3, VKORC1 ALDH1A1 462/4885NPSR1 4013/4885POLB 624/4885
US-20060122398-A1 Novel nickel-carbene, palladium-carbene and platinum-carbene complexes, their produciton and use in catalytic reactions PPOX, PDCD1, PDCD1LG2 ALDH1A1 3436/4885NPSR1 2901/4885POLB 370/4885
US-20230151054-A1 SULFUR EXTRUSION FROM DISULFIDES BY CARBENES TST, CBS, CTH ALDH1A1 1786/4885NPSR1 2543/4885POLB 4600/4885

“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.