SCHEMBL6617195

SCHEMBL6617195

CCc1ccc(C(=O)Nc2ccc(O)c(-c3cc(C4CC4)n(C(=O)NC4CC4)n3)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACKR3 P25106 1/20 0.41
▸ RAB9A P51151 5/20 0.40
▸ NPC1 O15118 5/20 0.39
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ POLB P06746 1/20 0.38
▸ KDM6B O15054 1/20 0.38
▸ KDM5A P29375 1/20 0.38
▸ KDM4D Q6B0I6 1/20 0.38
▸ KDM4C Q9H3R0 1/20 0.38
▸ KDM5B Q9UGL1 1/20 0.38
▸ KDM2A Q9Y2K7 1/20 0.38
▸ KDM3A Q9Y4C1 1/20 0.38
▸ MAPT P10636 6/20 0.38
▸ TP53 P04637 2/20 0.38
▸ THRB P10828 2/20 0.38
▸ MCHR1 Q99705 1/20 0.37
▸ CRACR2A Q9BSW2 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL6616766 0.87 ADCY1 (0.41) ACKR3RAB9ANPC1MEN1KMT2A
SCHEMBL6616663 0.87 RAB9A (0.39) ACKR3RAB9ANPC1MEN1KMT2A
SCHEMBL6615591 0.86 RAB9A (0.39) ACKR3RAB9ANPC1MEN1KMT2A
SCHEMBL6614797 0.85 RAB9A (0.38) ACKR3RAB9ANPC1MEN1KMT2A
SCHEMBL6618133 0.85 RAB9A (0.41) RAB9ANPC1MEN1KMT2AMAPT
SCHEMBL6615827 0.83 RAB9A (0.38) ACKR3RAB9ANPC1MEN1KMT2A
SCHEMBL6619769 0.83 LMNA (0.40) ACKR3RAB9ANPC1KDM6BKDM5A
SCHEMBL6604618 0.83 RAB9A (0.40) ACKR3RAB9ANPC1MEN1KMT2A
SCHEMBL6617319 0.83 RAB9A (0.40) RAB9ANPC1MEN1KMT2AMAPT
SCHEMBL6616846 0.83 NAMPT (0.42) ACKR3MAPTTP53SMN1; 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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