SCHEMBL6615384

SCHEMBL6615384

COc1ccccc1C(=O)Nc1ccc(O)c(-c2cc(C3CC3)n(C(=O)NCc3ccccc3)n2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 4/20 0.45
▸ GLA P06280 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ ALDH1A1 P00352 2/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ POLB P06746 2/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.42
▸ MAPT P10636 6/20 0.42
▸ TSHR P16473 3/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ KCNK3 O14649 2/20 0.41
▸ KCNK9 Q9NPC2 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ CASP3 P42574 2/20 0.41
▸ F2 P00734 1/20 0.40
▸ MTTP P55157 1/20 0.40
▸ SENP5 Q96HI0 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
SCHEMBL6615822 0.95 KCNMA1 (0.41) TP53GLAHPGDMEN1KMT2A
SCHEMBL6619099 0.93 KCNK3 (0.43) TP53MEN1KMT2APOLBRXFP1
SCHEMBL6616043 0.92 MAPT (0.43) TP53ALDH1A1MEN1KMT2APOLB
SCHEMBL6615915 0.91 PAX8 (0.49) TP53HPGDMEN1KMT2APOLB
SCHEMBL6618884 0.90 POLB (0.42) TP53HPGDMEN1KMT2APOLB
SCHEMBL6615311 0.89 CHRM5 (0.42) TP53MEN1KMT2APOLBRXFP1
SCHEMBL6621042 0.85 ACKR3 (0.40) HPGDALDH1A1KDM4ELMNACASP3
SCHEMBL6617233 0.84 NPC1 (0.43) TP53GLAHPGDMEN1KMT2A
SCHEMBL6616751 0.83 CRACR2A (0.45) HPGDALDH1A1MEN1KMT2APOLB
SCHEMBL6617585 0.83 ALDH1A1 (0.43) TP53GLAHPGDALDH1A1MEN1

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-1458379-A1 HYDROXYPHENYL-PYRAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM Pharmacia Italia S.p.A. (IT) 2004-09-22 — — EP claimed
WO-2003051358-A1 HYDROXYPHENYL-PYRAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM PHARMACIA ITALIA SPA (IT) 2003-06-26 — — WO claimed
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