SCHEMBL6748668

SCHEMBL6748668

NC(=O)c1ccc2ccccc2c1-c1c(C(N)=O)ccc2ccccc12

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
WDR5 P61964 1/20 0.68
KMT2A Q03164 3/20 0.50
ATM Q13315 2/20 0.50
LDHA P00338 1/20 0.50
KDM4E B2RXH2 5/20 0.49
POLB P06746 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
ALDH1A1 P00352 4/20 0.48
GAA P10253 3/20 0.48
NR4A1 P22736 1/20 0.45
NR4A2 P43354 1/20 0.45
NR4A3 Q92570 1/20 0.45
MEN1 O00255 2/20 0.45
TSHR P16473 2/20 0.44
HSD17B10 Q99714 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
CYP2A6 P11509 1/20 0.44
MAPT P10636 2/20 0.43
HPGD P15428 1/20 0.43
NPC1 O15118 1/20 0.43

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
SCHEMBL3196806 0.91 WDR5 (0.58) WDR5KMT2AATMLDHAKDM4E
SCHEMBL27927917 0.89 WDR5 (0.59) WDR5KMT2AATMLDHAKDM4E
SCHEMBL29876488 0.89 WDR5 (0.55) WDR5KMT2AATMLDHAKDM4E
SCHEMBL12441442 0.85 WDR5 (0.51) WDR5KMT2AATMLDHAKDM4E
SCHEMBL5925684 0.84 WDR5 (0.63) WDR5KMT2AATMLDHAKDM4E
SCHEMBL29013084 0.83 WDR5 (0.49) WDR5KDM4ESMN1; SMN2ALDH1A1MAPT
SCHEMBL5610965 0.82 WDR5 (0.47) WDR5KMT2AATMLDHAKDM4E
SCHEMBL6053791 0.82 WDR5 (0.51) WDR5KMT2AATMLDHAKDM4E
SCHEMBL2325577 0.82 WDR5 (0.51) WDR5KMT2AATMLDHAKDM4E
SCHEMBL8097610 0.82 CYP1A1 (0.57) WDR5KMT2AATMLDHAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1092729-B1 POLYMERIZATION CATALYST, NOVEL TRANSITION METAL COMPOUND, AND POLYMERIZATION METHOD AND COPOLYMER USING THEM MITSUI CHEMICALS INC (JP) 2012-09-26 EP disclosed
US-6703459-B1 ORGANIC TRANSITION METAL COMPLEXES HAVING SPECIFIC STRUCTURE, WHICH CAN FORM COPOLYMERS HAVING LINKAGE FORMED BY MIGRATION OF ACTIVE HYDROGEN OF UNSATURATED MONOMER MITSUI CHEMICALS, INC. (JP) 2004-03-09 US disclosed
EP-1092729-A1 POLYMERIZATION CATALYST, NOVEL TRANSITION METAL COMPOUND, AND POLYMERIZATION METHOD AND COPOLYMER USING THEM Mitsui Chemicals, Inc. (JP) 2001-04-18 EP disclosed