SCHEMBL6618271

SCHEMBL6618271

CC(=O)Nc1ccc(O)c(-c2cc(C3CC3)n(C(=O)NCc3ccccc3Cl)n2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.41
▸ GAA P10253 2/20 0.39
▸ TP53 P04637 1/20 0.39
▸ CHRNE Q04844 2/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ RAB9A P51151 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ 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
▸ ANO1 Q5XXA6 1/20 0.37
▸ CNR1 P21554 1/20 0.36
▸ KCNJ6 P48051 1/20 0.36
▸ KCNJ5 P48544 1/20 0.36
▸ KCNJ3 P48549 1/20 0.36
▸ HSD17B2 P37059 1/20 0.36
▸ ACKR3 P25106 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
SCHEMBL6617721 0.90 EPHX2 (0.39) MAPTCHRNEMEN1KMT2ARAB9A
SCHEMBL6617644 0.90 ACKR3 (0.40) MAPTGAATP53ANO1CNR1
SCHEMBL6617374 0.89 TP53 (0.39) MAPTGAATP53MEN1KMT2A
SCHEMBL6603399 0.89 ALDH1A1 (0.45) GAATP53MEN1KMT2AANO1
SCHEMBL6617183 0.88 ALDH1A1 (0.40) MAPTTP53RAB9AKDM4EANO1
SCHEMBL6617068 0.88 PKM (0.38) MAPTGAATP53RAB9AKDM4E
SCHEMBL6617727 0.88 GNRHR (0.39) MAPTGAAMEN1KMT2ARAB9A
SCHEMBL6615311 0.87 CHRM5 (0.42) MAPTTP53MEN1KMT2ARAB9A
SCHEMBL6647398 0.86 KMT2A (0.38) MAPTCHRNEMEN1KMT2ARAB9A
SCHEMBL6615944 0.86 ALDH1A1 (0.43) GAATP53MEN1KMT2AKDM4E

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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