SCHEMBL4760890

SCHEMBL4760890

Cn1c(=O)ccc2c3c(-c4ccc(Cl)cc4Cl)c(-c4cc[nH]n4)ccc3n(C)c21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 3/20 0.34
▸ MCHR1 Q99705 2/20 0.34
▸ ALPL P05186 4/20 0.33
▸ DPP4 P27487 1/20 0.33
▸ GSK3A P49840 2/20 0.32
▸ GSK3B P49841 2/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ HPGD P15428 2/20 0.32
▸ CYP1A2 P05177 2/20 0.32
▸ GAA P10253 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ RGS12 O14924 1/20 0.32
▸ GMNN O75496 1/20 0.32
▸ USP2 O75604 1/20 0.32
▸ CCNB2 O95067 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ CDK1 P06493 1/20 0.32

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
SCHEMBL4762649 0.88 BRD4 (0.34) WEE1
SCHEMBL3140269 0.75 RIPK2 (0.38) HSD11B1ALPLGSK3AGSK3BKDM4E
SCHEMBL3140274 0.73 KDM4E (0.44) HSD11B1DPP4GSK3AGSK3BKDM4E
SCHEMBL4760378 0.73 HPGD (0.33) KDM4EALDH1A1HPGDCYP1A2MEN1
SCHEMBL1339349 0.72 KDM4E (0.36) HSD11B1ALPLKDM4EALDH1A1HPGD
SCHEMBL3846339 0.69 ALPL (0.49) ALPLKDM4ELMNAMAPTMAPK1
SCHEMBL4762650 0.65 CYP3A4 (0.34) KDM4EALDH1A1HPGDCYP1A2MEN1
SCHEMBL1338134 0.64 CNR1 (0.33) HSD11B1ALPLKDM4EALDH1A1HPGD
SCHEMBL11624239 0.61 IDO1 (0.56) ALPLALDH1A1HPGDMEN1TP53
SCHEMBL1339221 0.59 HSD11B1 (0.37) HSD11B1GSK3AGSK3BKDM4EALDH1A1

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-1940840-A1 6-HETEROARYLPYRIDOINDOLONE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2008-07-09 — — EP disclosed
WO-2007045758-A1 6-HETEROARYLPYRIDOINDOLONE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF SANOFI AVENTIS (FR) 2007-04-26 — — WO disclosed
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