SCHEMBL6617712

SCHEMBL6617712

Cc1ccc(CNC(=O)n2nc(-c3cc(NC(=O)c4cccc(C(F)(F)F)c4)ccc3O)cc2C2CCC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ RAF1 P04049 13/20 0.44
▸ POLB P06746 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ BRAF P15056 10/20 0.43
▸ LMNA P02545 1/20 0.43
▸ TP53 P04637 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ CCR2 P41597 1/20 0.42
▸ KCNK3 O14649 1/20 0.41
▸ KCNK9 Q9NPC2 1/20 0.41

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
SCHEMBL6672260 0.94 MEN1 (0.45) RAF1BRAFMEN1HTTRAB9A
SCHEMBL6620165 0.94 RAF1 (0.44) RAF1POLBBRAFLMNAKCNK3
SCHEMBL6615137 0.92 RAF1 (0.41) RAF1POLBBRAFCCR2
SCHEMBL6617441 0.89 RAF1 (0.45) RAF1BRAFCCR2
SCHEMBL6614038 0.89 KCNK3 (0.44) RAF1POLBBRAFLMNARAB9A
SCHEMBL6685899 0.89 RAF1 (0.42) RAF1POLBBRAFKCNK3
SCHEMBL6619787 0.89 MAPK14 (0.41) POLBLMNAMAPTMEN1RAB9A
SCHEMBL6616122 0.88 RAF1 (0.46) RAF1POLBBRAF
SCHEMBL6614784 0.87 POLB (0.41) POLBMAPT
SCHEMBL6618645 0.86 TP53 (0.49) RAF1POLBBRAFLMNATP53

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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