SCHEMBL6910591

SCHEMBL6910591

C#Cc1cccc2c1C(=O)N(c1cccc(N)c1)C2=O.c1cc2ccc1-2

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.49
USP2 O75604 2/20 0.49
KMT2A Q03164 2/20 0.49
KEAP1 Q14145 2/20 0.49
NFE2L2 Q16236 2/20 0.49
HSPA1A P0DMV8 1/20 0.47
PABPC1 P11940 1/20 0.47
TYMS P04818 3/20 0.41
ADORA2A P29274 1/20 0.41
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.36
MAPT P10636 1/20 0.36
DPP4 P27487 1/20 0.36
NR1H3 Q13133 1/20 0.36
SCN2A Q99250 1/20 0.35
ALDH1A1 P00352 2/20 0.35

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
SCHEMBL3447118 0.86 HSPA1A (0.41) HSPA1APABPC1TYMSADORA2ACA12
SCHEMBL7686000 0.85 HSPA1A (0.56) MEN1USP2KMT2AKEAP1NFE2L2
SCHEMBL28505833 0.85 NPC1 (0.54) MEN1USP2KMT2AHSPA1APABPC1
SCHEMBL28484463 0.81 TYMS (0.62) MEN1KMT2ATYMSCA12CA1
SCHEMBL10747857 0.81 ADORA2A (0.37) MEN1KMT2AHSPA1APABPC1TYMS
SCHEMBL9566668 0.79 HSPA1A (0.73) MEN1USP2KMT2AKEAP1NFE2L2
SCHEMBL19836885 0.78 KMT2A (0.56) MEN1USP2KMT2AKEAP1NFE2L2
SCHEMBL19411342 0.76 CA12 (0.57) MEN1KMT2AHSPA1APABPC1TYMS
SCHEMBL13910988 0.75 KMT2A (0.67) MEN1USP2KMT2AKEAP1NFE2L2
SCHEMBL19411348 0.72 KMT2A (0.48) MEN1KMT2AADORA2AL3MBTL1MAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0966493-A4 REDUCED TEMPERATURE CURING OF ACETYLENIC POLYMERS COMMW SCIENT IND RES ORG (AU) 2004-04-21 EP disclosed
US-6344523-B1 POLYIMIDES COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANIZATION OF CAMPBELL (AU) 2002-02-05 US disclosed
EP-0966493-A1 REDUCED TEMPERATURE CURING OF ACETYLENIC POLYMERS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 1999-12-29 EP disclosed
WO-1998040422-A1 REDUCED TEMPERATURE CURING OF ACETYLENIC POLYMERS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 1998-09-17 WO disclosed