SCHEMBL6615822

SCHEMBL6615822

COc1ccccc1C(=O)Nc1ccc(O)c(-c2cc(C3CC3)n(C(=O)NCc3ccc(C)cc3)n2)c1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KCNMA1 Q12791 1/20 0.41
▸ MAPT P10636 4/20 0.41
▸ POLB P06746 3/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ RXFP1 Q9HBX9 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ KCNK3 O14649 3/20 0.40
▸ KCNK9 Q9NPC2 3/20 0.40
▸ TP53 P04637 3/20 0.40
▸ CASP3 P42574 2/20 0.40
▸ PAX8 Q06710 1/20 0.39
▸ GLA P06280 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ CRACR2A Q9BSW2 1/20 0.39

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
SCHEMBL6615384 0.95 TP53 (0.45) MAPTPOLBSMN1; SMN2KMT2ARXFP1
SCHEMBL6619099 0.93 KCNK3 (0.43) KCNMA1MAPTPOLBSMN1; SMN2KMT2A
SCHEMBL6615915 0.91 PAX8 (0.49) KCNMA1MAPTPOLBSMN1; SMN2KMT2A
SCHEMBL6618884 0.90 POLB (0.42) KCNMA1MAPTPOLBSMN1; SMN2KMT2A
SCHEMBL6616751 0.88 CRACR2A (0.45) MAPTPOLBSMN1; SMN2KMT2AMEN1
SCHEMBL6615311 0.88 CHRM5 (0.42) KCNMA1MAPTPOLBKMT2ARXFP1
SCHEMBL6616043 0.88 MAPT (0.43) MAPTPOLBSMN1; SMN2KMT2ARXFP1
SCHEMBL6618455 0.87 LMNA (0.39) MAPTPOLBKMT2AMEN1KDM4E
SCHEMBL6613151 0.86 ALDH1A1 (0.41) MAPTPOLBSMN1; SMN2KMT2AMEN1
SCHEMBL6617233 0.86 NPC1 (0.43) MAPTSMN1; SMN2KMT2AMEN1KDM4E

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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