SCHEMBL6618316

SCHEMBL6618316

CCc1ccc(C(=O)Nc2ccc(-c3cc(C4CC4)n(C(=O)NCc4ccc(F)cc4)n3)c(O)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.42
▸ TP53 P04637 2/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ CTNNB1 P35222 2/20 0.41
▸ TCF7L2 Q9NQB0 2/20 0.41
▸ ENPP2 Q13822 5/20 0.40
▸ P2RY14 Q15391 1/20 0.40
▸ NAMPT P43490 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.39
▸ LMNA P02545 2/20 0.39
▸ GAA P10253 1/20 0.39
▸ HTR1F P30939 2/20 0.39
▸ HTR1A P08908 1/20 0.39
▸ CRACR2A Q9BSW2 1/20 0.39
▸ RAB9A P51151 1/20 0.38

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
SCHEMBL6614537 0.92 ACKR3 (0.41) MAPTTP53SMN1; SMN2ALDH1A1LMNA
SCHEMBL6615882 0.92 NR1H4 (0.41) CTNNB1TCF7L2ENPP2NAMPTHTR1F
SCHEMBL6616947 0.90 SSTR3 (0.43) MAPTCTNNB1TCF7L2P2RY14NAMPT
SCHEMBL6616422 0.90 NAMPT (0.45) CTNNB1TCF7L2NAMPT
SCHEMBL6618133 0.90 RAB9A (0.41) MAPTTP53SMN1; SMN2CRACR2ARAB9A
SCHEMBL6617319 0.88 RAB9A (0.40) MAPTTP53SMN1; SMN2NAMPTCRACR2A
SCHEMBL6616244 0.88 NAMPT (0.41) MAPTTP53SMN1; SMN2NAMPTALDH1A1
SCHEMBL6616846 0.87 NAMPT (0.42) MAPTTP53SMN1; SMN2NAMPTLMNA
SCHEMBL6619674 0.87 NAMPT (0.43) MAPTTP53NAMPTALDH1A1LMNA
SCHEMBL6620121 0.86 CASP3 (0.50) MAPTTP53SMN1; SMN2NAMPTALDH1A1

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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