SCHEMBL6619674

SCHEMBL6619674

CCOc1ccc(C(=O)Nc2ccc(O)c(-c3cc(C4CC4)n(C(=O)NCc4ccc(F)cc4)n3)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 1/20 0.43
▸ CYP2C9 P11712 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ MAPT P10636 6/20 0.42
▸ HSD17B10 Q99714 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ STAT5A P42229 1/20 0.39
▸ STAT5B P51692 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ ADRB2 P07550 1/20 0.39
▸ CACNA1B Q00975 1/20 0.39
▸ APBA1 Q02410 1/20 0.39
▸ SAE1 Q9UBE0 1/20 0.39
▸ UBA2 Q9UBT2 1/20 0.39

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
SCHEMBL6615885 0.93 NPC1 (0.47) NAMPTCYP2C9MAPTALDH1A1LMNA
SCHEMBL6619399 0.90 MAPT (0.47) NAMPTCYP2C9CYP2C19MAPTALDH1A1
SCHEMBL6616574 0.88 NR1H4 (0.42) NAMPTCYP2C9CYP2C19MAPTHSD17B10
SCHEMBL6656520 0.88 MEN1 (0.40) NAMPTMAPTLMNAMEN1KMT2A
SCHEMBL6614784 0.88 POLB (0.41) MAPTALDH1A1
SCHEMBL6618316 0.87 MAPT (0.42) NAMPTMAPTALDH1A1LMNARAB9A
SCHEMBL6617914 0.86 KMT2A (0.47) MAPTHSD17B10ALDH1A1LMNAMEN1
SCHEMBL6619981 0.85 ALDH1A1 (0.39) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL6616422 0.85 NAMPT (0.45) NAMPTSLC2A1
SCHEMBL6616846 0.85 NAMPT (0.42) NAMPTMAPTLMNASTAT5ASTAT5B

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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