SCHEMBL6615297

SCHEMBL6615297

Cc1ccccc1CNC(=O)n1nc(-c2ccc(NC(=O)CC(C)C)cc2O)cc1C1CCCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ NPC1 O15118 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ NFKB1 P19838 1/20 0.38
▸ NFKB2 Q00653 1/20 0.38
▸ RELA Q04206 1/20 0.38
▸ MAPK14 Q16539 1/20 0.38
▸ F2R P25116 1/20 0.38
▸ GAA P10253 2/20 0.37
▸ EPHX2 P34913 1/20 0.37
▸ ROCK2 O75116 1/20 0.36
▸ LMNA P02545 1/20 0.35
▸ AAK1 Q2M2I8 1/20 0.35
▸ RXFP1 Q9HBX9 1/20 0.35
▸ BCHE P06276 1/20 0.34

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
SCHEMBL6618110 0.98 RAB9A (0.38) RAB9AKMT2AMEN1SMN1; SMN2NPC1
SCHEMBL6621748 0.91 CNR1 (0.40) RAB9AKMT2AMEN1SMN1; SMN2NPC1
SCHEMBL6620336 0.91 POLB (0.40) RAB9AKMT2AMEN1SMN1; SMN2NPC1
SCHEMBL6620062 0.90 CNR1 (0.40) RAB9AKMT2AMEN1SMN1; SMN2NPC1
SCHEMBL6616445 0.89 SMN1; SMN2 (0.41) RAB9AKMT2AMEN1SMN1; SMN2NPC1
SCHEMBL6616479 0.89 EPHX2 (0.38) RAB9AKMT2AMEN1SMN1; SMN2NPC1
SCHEMBL6618283 0.88 CNR1 (0.41) RAB9AKMT2AMEN1SMN1; SMN2NPC1
SCHEMBL6617191 0.88 SMN1; SMN2 (0.41) RAB9AKMT2AMEN1SMN1; SMN2NPC1
SCHEMBL6616981 0.88 GNRHR (0.41) RAB9AKMT2AMEN1SMN1; SMN2NPC1
SCHEMBL6618080 0.87 GAA (0.37) RAB9AKMT2AMEN1SMN1; SMN2NPC1

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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