SCHEMBL6618924

SCHEMBL6618924

COc1ccc(CNC(=O)n2nc(-c3ccc(NC(=O)c4cccnc4Cl)cc3O)cc2C2CC2)cc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.47
▸ POLB P06746 2/20 0.47
▸ GAA P10253 2/20 0.47
▸ NAMPT P43490 1/20 0.42
▸ ALDH1A1 P00352 3/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ ACKR3 P25106 1/20 0.40
▸ RAB9A P51151 3/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ EGLN1 Q9GZT9 1/20 0.39
▸ CNR1 P21554 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
SCHEMBL6619166 0.89 MAPT (0.44) MAPTPOLBGAAALDH1A1MEN1
SCHEMBL6604438 0.89 MAPT (0.44) MAPTPOLBALDH1A1SMN1; SMN2MEN1
SCHEMBL6613151 0.87 ALDH1A1 (0.41) MAPTPOLBGAAALDH1A1SMN1; SMN2
SCHEMBL6616412 0.86 MAPT (0.41) MAPTPOLBNAMPTALDH1A1SMN1; SMN2
SCHEMBL6616478 0.85 ACKR3 (0.44) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL6615212 0.84 MAPT (0.47) MAPTPOLBGAAALDH1A1SMN1; SMN2
SCHEMBL6605138 0.84 MAPT (0.42) MAPTPOLBALDH1A1SMN1; SMN2MEN1
SCHEMBL6618339 0.84 ACKR3 (0.44) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL6617585 0.83 ALDH1A1 (0.43) MAPTPOLBGAAALDH1A1MEN1
SCHEMBL6618827 0.83 ACKR3 (0.40) MAPTPOLBGAAALDH1A1SMN1; SMN2

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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