SCHEMBL6616846

SCHEMBL6616846

CCc1ccc(C(=O)Nc2ccc(O)c(-c3cc(C4CC4)n(C(=O)NCc4cccc(F)c4)n3)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 2/20 0.42
▸ MAPT P10636 6/20 0.40
▸ HDAC1 Q13547 1/20 0.39
▸ TP53 P04637 3/20 0.39
▸ JAK2 O60674 1/20 0.39
▸ PTGDR2 Q9Y5Y4 2/20 0.38
▸ CHRNE Q04844 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ LMNA P02545 3/20 0.37
▸ GAA P10253 1/20 0.36
▸ ACKR3 P25106 2/20 0.36
▸ STAT5A P42229 1/20 0.36
▸ STAT5B P51692 1/20 0.36
▸ ROCK2 O75116 1/20 0.36
▸ ROCK1 Q13464 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
SCHEMBL6615977 0.90 LMNA (0.42) NAMPTMAPTHDAC1TP53JAK2
SCHEMBL6619769 0.88 LMNA (0.40) MAPTHDAC1SMN1; SMN2LMNAACKR3
SCHEMBL6618316 0.87 MAPT (0.42) NAMPTMAPTTP53SMN1; SMN2LMNA
SCHEMBL6614876 0.87 MEN1 (0.43) NAMPTMAPTHDAC1TP53JAK2
SCHEMBL6616244 0.87 NAMPT (0.41) NAMPTMAPTTP53SMN1; SMN2LMNA
SCHEMBL6614537 0.86 ACKR3 (0.41) MAPTTP53SMN1; SMN2LMNAACKR3
SCHEMBL6617954 0.86 EPHX2 (0.40) NAMPTJAK2PTGDR2CHRNE
SCHEMBL6622320 0.86 MAPT (0.42) MAPTTP53SMN1; SMN2LMNA
SCHEMBL6616321 0.86 CHRNE (0.38) NAMPTCHRNELMNAROCK2
SCHEMBL6615537 0.85 LMNA (0.45) NAMPTMAPTHDAC1TP53JAK2

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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