SCHEMBL9566635

SCHEMBL9566635

Nc1cccc(N2C(=O)c3ccc(I)cc3C2=O)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.57
MEN1 O00255 3/20 0.57
USP2 O75604 3/20 0.57
KEAP1 Q14145 3/20 0.57
NFE2L2 Q16236 3/20 0.57
NPC1 O15118 3/20 0.50
RAB9A P51151 3/20 0.50
ALDH1A1 P00352 3/20 0.50
TSHR P16473 2/20 0.50
CASP1 P29466 2/20 0.50
ESR1 P03372 2/20 0.50
MAPK1 P28482 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
CASP7 P55210 1/20 0.50
HSD17B10 Q99714 1/20 0.50
ANPEP P15144 2/20 0.48
DPP4 P27487 1/20 0.48
FAAH O00519 1/20 0.44
MGLL Q99685 1/20 0.44
MAPT P10636 2/20 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
SCHEMBL9571688 0.89 ESR1 (0.57) KMT2AMEN1USP2KEAP1NFE2L2
SCHEMBL9566591 0.88 NPC1 (0.58) KMT2AMEN1USP2KEAP1NFE2L2
SCHEMBL9453259 0.87 FAAH (0.58) KMT2AMEN1USP2KEAP1NFE2L2
SCHEMBL9566664 0.87 NPC1 (0.65) KMT2AMEN1USP2KEAP1NFE2L2
SCHEMBL9571706 0.84 CASP1 (0.71) KMT2AMEN1NPC1RAB9AALDH1A1
SCHEMBL13910988 0.83 KMT2A (0.67) KMT2AMEN1USP2KEAP1NFE2L2
SCHEMBL9571687 0.82 HSPA1A (0.61) KMT2AMEN1USP2KEAP1NFE2L2
SCHEMBL9566639 0.82 NPC1 (0.63) KMT2AMEN1NPC1RAB9AALDH1A1
SCHEMBL8910341 0.82 ESR1 (0.64) KMT2AMEN1USP2KEAP1NFE2L2
SCHEMBL9468849 0.82 NPC1 (0.67) KMT2AMEN1USP2KEAP1NFE2L2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0530707-A1 Method for preparing polyamide-imides EASTMAN KODAK COMPANY (US) 1993-03-10 EP claimed
EP-0530707-A1 Method for preparing polyamide-imides EASTMAN KODAK COMPANY (US) 1993-03-10 EP disclosed