SCHEMBL6617159

SCHEMBL6617159

Cc1ccccc1CNC(=O)n1nc(-c2ccc(NC(=O)c3c(Cl)cccc3Cl)cc2O)cc1C1CCCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 4/20 0.38
▸ TYK2 P29597 4/20 0.38
▸ NPC1 O15118 3/20 0.38
▸ RAB9A P51151 3/20 0.38
▸ PPARG P37231 1/20 0.37
▸ JAK1 P23458 2/20 0.36
▸ EPHX2 P34913 1/20 0.36
▸ CRACR2A Q9BSW2 2/20 0.36
▸ CDK9 P50750 1/20 0.35
▸ JAK3 P52333 1/20 0.35
▸ USP2 O75604 1/20 0.35
▸ THRB P10828 1/20 0.35
▸ ACKR3 P25106 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ PTPRC P08575 1/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ NR1H4 Q96RI1 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ TP53 P04637 1/20 0.35

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
SCHEMBL6618955 0.94 JAK2 (0.40) JAK2TYK2NPC1RAB9AJAK1
SCHEMBL6615258 0.91 CNR1 (0.41) JAK2TYK2NPC1RAB9AJAK1
SCHEMBL6618535 0.89 CNR1 (0.41) JAK2TYK2NPC1RAB9AJAK1
SCHEMBL6618981 0.89 JAK2 (0.40) JAK2TYK2JAK1CRACR2ACDK9
SCHEMBL6621181 0.88 LMNA (0.40) JAK2TYK2NPC1RAB9AJAK1
SCHEMBL6616981 0.88 GNRHR (0.41) NPC1RAB9AEPHX2L3MBTL1KMT2A
SCHEMBL6609028 0.88 TYK2 (0.43) JAK2TYK2JAK1CRACR2ACDK9
SCHEMBL6620229 0.88 PPARG (0.42) NPC1RAB9APPARGEPHX2CRACR2A
SCHEMBL6619665 0.87 P2RY14 (0.41) NPC1RAB9AEPHX2TP53
SCHEMBL6618279 0.87 MAPK14 (0.41) NPC1RAB9AUSP2THRBACKR3

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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