SCHEMBL242518

SCHEMBL242518

C/C(=N\c1c(C(C)C)cccc1C(C)C)c1ccccn1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.53
ALDH1A1 P00352 2/20 0.43
TOP2A P11388 2/20 0.42
NPC1 O15118 5/20 0.42
RAB9A P51151 5/20 0.42
AGTR1 P30556 5/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
GAA P10253 2/20 0.42
MAPT P10636 2/20 0.42
LMNA P02545 2/20 0.42
MITF O75030 1/20 0.42
HTT P42858 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
OPRK1 P41145 2/20 0.41
ALOX12 P18054 1/20 0.40
GFER P55789 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
SLC2A1 P11166 1/20 0.40

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
SCHEMBL8166694 1.00 KDM4E (0.53) KDM4EALDH1A1TOP2ANPC1RAB9A
SCHEMBL242519 1.00 KDM4E (0.53) KDM4EALDH1A1TOP2ANPC1RAB9A
SCHEMBL8167553 0.98 KDM4E (0.51) KDM4EALDH1A1TOP2ANPC1RAB9A
Hydrochloric Acid SCHEMBL5083705 0.98 KDM4E (0.51) KDM4EALDH1A1TOP2ANPC1RAB9A
SCHEMBL16471834 0.91 KDM4E (0.47) KDM4EALDH1A1TOP2ANPC1RAB9A
SCHEMBL5589427 0.91 KDM4E (0.47) KDM4EALDH1A1TOP2ANPC1RAB9A
SCHEMBL5693530 0.90 KDM4E (0.46) KDM4EALDH1A1TOP2ANPC1RAB9A
SCHEMBL8172155 0.86 KDM4E (0.44) KDM4EALDH1A1NPC1RAB9AAGTR1
SCHEMBL20094447 0.86 KDM4E (0.54) KDM4EALDH1A1TOP2ANPC1RAB9A
Hydrochloric Acid SCHEMBL8173542 0.85 KDM4E (0.42) KDM4EALDH1A1NPC1RAB9AAGTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10981846-B1 Producing cyclic fuels from conjugated diene THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2021-04-20 US claimed
EP-1363923-B1 RHODIUM AND IRIDIUM COMPLEXES MERCK PATENT GMBH (DE) 2009-04-01 EP claimed
US-20240260448-A1 Metal Complexes UDC IRELAND LIMITED (IE) 2024-08-01 US disclosed
US-11917901-B2 Metal complexes UDC IRELAND LIMITED (IE) 2024-02-27 US disclosed
EP-3374081-B1 VANADIUM PYRIDINE-IMINE COMPLEX, CATALYTIC SYSTEM COMPRISING SAID VANADIUM PYRIDINE-IMMINE COMPLEX AND A (CO) POLYMERIZATION PROCESS OF CONJUGATED DIENES VERSALIS SPA (IT) 2021-06-16 EP disclosed
US-11005050-B2 Metal complexes MERCK PATENT GMBH (DE) 2021-05-11 US disclosed
US-10981846-B1 Producing cyclic fuels from conjugated diene THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2021-04-20 US disclosed
EP-3529289-B1 PROCESS FOR PREPARING CONJUGATED DIENE (CO)POLYMERS IN THE PRESENCE OF A CATALYTIC SYSTEM COMPRISING A PYRIDYL IRON (III) COMPLEX VERSALIS SPA (IT) 2020-12-02 EP disclosed
US-10793653-B2 Process for preparing conjugated diene (co)polymers in the presence of a catalytic system comprising a pyridyl iron (III) complex VERSALIS S.P.A. (IT) 2020-10-06 US disclosed
US-10654952-B2 Nitrogen titanium complex, catalytic system comprising said nitrogen titanium complex and process for the (co)polymerization of conjugated dienes VERSALIS S.P.A. (IT) 2020-05-19 US disclosed
US-10633474-B2 Vanadium pyridine-imine complex, catalytic system comprising said vanadium pyridine-immine complex and a (co) polymerization process of conjugated dienes VERSALIS S.P.A. (IT) 2020-04-28 US disclosed
US-20130284977-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2013-10-31 US disclosed
US-20130253617-A1 PHOSPHORUS-CONTAINING METAL COMPLEXES MERCK PATENT GMBH (DE) 2013-09-26 US disclosed
WO-2013097920-A1 METAL COMPLEXES COMPRISING 1,2,3-TRIAZOLES MERCK PATENT GMBH (DE) 2013-07-04 WO disclosed
US-20130116755-A1 METAL COMPLEXES WITH ORGANIC LIGANDS AND USE THEREOF IN OLEDS MERCK PATENT GMBH (DE) 2013-05-09 US disclosed
US-20130082209-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2013-04-04 US disclosed
US-20120004407-A1 METAL COMPLEXES HAVING AZABOROL LIGANDS AND ELECTRONIC DEVICE HAVING THE SAME MERCK PATENT GMBH (DE) 2012-01-05 US disclosed
US-20100176386-A1 LUMINESCENT METAL COMPLEXES FOR ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2010-07-15 US disclosed
US-7199255-B2 Imino-amide catalysts for olefin polymerization UNIVATION TECHNOLOGIES, LLC (US) 2007-04-03 US disclosed
US-7199255-B2 Imino-amide catalysts for olefin polymerization UNIVATION TECHNOLOGIES, LLC (US) 2007-04-03 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 (10 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-20100176386-A1 LUMINESCENT METAL COMPLEXES FOR ORGANIC ELECTRONIC DEVICES OCIAD2, OCIAD1, OSTC KDM4E 4222/4885ALDH1A1 1304/4885TOP2A 4393/4885
US-10633474-B2 Vanadium pyridine-imine complex, catalytic system comprising said vanadium pyridine-immine complex and a (co) polymerization process of conjugated dienes NOX4, CBR3, CYP4F3 KDM4E 1838/4885ALDH1A1 1632/4885TOP2A 1593/4885
US-20120004407-A1 METAL COMPLEXES HAVING AZABOROL LIGANDS AND ELECTRONIC DEVICE HAVING THE SAME ICOSLG, ERAL1, CTCF KDM4E 2177/4885ALDH1A1 1796/4885TOP2A 4608/4885
US-10981846-B1 Producing cyclic fuels from conjugated diene FDFT1, PC, NDUFS8 KDM4E 2761/4885ALDH1A1 900/4885TOP2A 1970/4885
US-11005050-B2 Metal complexes SOD1, AP1M1, AP3M1 KDM4E 3816/4885ALDH1A1 3721/4885TOP2A 3772/4885
US-10793653-B2 Process for preparing conjugated diene (co)polymers in the presence of a catalytic system comprising a pyridyl iron (III) complex AOC3, C5, AOC2 KDM4E 4296/4885ALDH1A1 1129/4885TOP2A 1039/4885
US-20130082209-A1 METAL COMPLEXES MCOLN2, MCOLN1, AP1M1 KDM4E 4129/4885ALDH1A1 2790/4885TOP2A 3466/4885
US-10654952-B2 Nitrogen titanium complex, catalytic system comprising said nitrogen titanium complex and process for the (co)polymerization of conjugated dienes CAT, NSFL1C, NCLN KDM4E 3207/4885ALDH1A1 1731/4885TOP2A 634/4885
US-11917901-B2 Metal complexes MCOLN2, MCOLN1, AP1M1 KDM4E 4260/4885ALDH1A1 1631/4885TOP2A 3261/4885
US-20240260448-A1 Metal Complexes SOD1, AP1M1, AP3M1 KDM4E 3816/4885ALDH1A1 3721/4885TOP2A 3772/4885

“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.