SCHEMBL6617192

SCHEMBL6617192

CCOc1ccc(C(=O)Nc2ccc(O)c(-c3cc(C4CC4)n(C(=O)NCc4ccccc4Cl)n3)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.43
▸ TP53 P04637 3/20 0.42
▸ ACKR3 P25106 1/20 0.41
▸ LMNA P02545 2/20 0.41
▸ EPHX2 P34913 1/20 0.41
▸ NR1H4 Q96RI1 1/20 0.41
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ THRB P10828 1/20 0.40
▸ NPC1 O15118 3/20 0.40
▸ RPS6KA2 Q15349 1/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ POLB P06746 1/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ NAMPT P43490 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ TAS1R3 Q7RTX0 1/20 0.38
▸ TAS1R1 Q7RTX1 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
SCHEMBL6656520 0.91 MEN1 (0.40) MAPTTP53LMNAMEN1KMT2A
SCHEMBL6619399 0.88 MAPT (0.47) MAPTTP53LMNAMEN1KMT2A
SCHEMBL6660284 0.88 ACKR3 (0.42) MAPTTP53ACKR3LMNAMEN1
SCHEMBL6617644 0.86 ACKR3 (0.40) MAPTTP53ACKR3LMNATHRB
SCHEMBL6618271 0.86 MAPT (0.41) MAPTTP53ACKR3MEN1KMT2A
SCHEMBL6615885 0.86 NPC1 (0.47) MAPTACKR3LMNAMEN1KMT2A
SCHEMBL6617708 0.86 ACKR3 (0.41) MAPTACKR3LMNATHRBSMN1; SMN2
SCHEMBL6617916 0.86 NAMPT (0.44) MAPTTP53LMNAMEN1KMT2A
SCHEMBL6616574 0.85 NR1H4 (0.42) MAPTTP53LMNANR1H4MEN1
SCHEMBL6613041 0.85 TRPV1 (0.44) MAPTACKR3LMNAEPHX2NR1H4

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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