SCHEMBL6616130

SCHEMBL6616130

CC(=O)Nc1ccc(O)c(-c2cc(C3CC3)n(C(=O)NCc3cccc(C)c3)n2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ASAH1 Q13510 2/20 0.38
▸ MEN1 O00255 4/20 0.37
▸ KMT2A Q03164 4/20 0.37
▸ RAB9A P51151 3/20 0.37
▸ NPC1 O15118 2/20 0.37
▸ ROCK2 O75116 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ KDM5A P29375 1/20 0.37
▸ KDM4D Q6B0I6 1/20 0.37
▸ KDM4C Q9H3R0 1/20 0.37
▸ KDM5B Q9UGL1 1/20 0.37
▸ KDM3A Q9Y4C1 1/20 0.37
▸ CHRNE Q04844 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ HPGD P15428 1/20 0.36
▸ KCNJ6 P48051 2/20 0.36
▸ KCNJ3 P48549 2/20 0.36
▸ KCNJ5 P48544 1/20 0.36
▸ MAPT P10636 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36

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
SCHEMBL6615761 0.90 KDM5A (0.39) MEN1KMT2ARAB9ANPC1MAPK1
SCHEMBL6616878 0.89 KMT2A (0.38) ASAH1MEN1KMT2ARAB9ANPC1
SCHEMBL6618149 0.89 MAPK14 (0.37) ASAH1MEN1KMT2ARAB9ANPC1
SCHEMBL6602660 0.88 TERT (0.36) ASAH1MEN1KMT2ARAB9ANPC1
SCHEMBL6618192 0.88 NAMPT (0.36) ASAH1MEN1KMT2ARAB9ANPC1
SCHEMBL6617603 0.87 CHRNE (0.45) MEN1KMT2AROCK2KDM5AKDM4D
SCHEMBL6616798 0.87 KDM4C (0.44) MEN1KMT2ARAB9ANPC1ROCK2
SCHEMBL6616425 0.87 NAMPT (0.40) MEN1KMT2ARAB9ANPC1ROCK2
SCHEMBL6618968 0.87 CRACR2A (0.42) RAB9ANPC1ROCK2TSHR
SCHEMBL6617955 0.86 KMT2A (0.37) ASAH1MEN1KMT2ARAB9ANPC1

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
Send feedback