SCHEMBL6615863

SCHEMBL6615863

C=CCNC(=O)n1nc(-c2ccc(NC(=O)c3ccc(CC)cc3)cc2O)cc1C1CC1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.40
▸ NPC1 O15118 4/20 0.40
▸ CRACR2A Q9BSW2 1/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ MAPT P10636 6/20 0.37
▸ TP53 P04637 2/20 0.37
▸ THRB P10828 1/20 0.37
▸ PTGDR2 Q9Y5Y4 4/20 0.36
▸ MCHR1 Q99705 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ POLB P06746 1/20 0.36

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
SCHEMBL6615827 0.92 RAB9A (0.38) RAB9ANPC1CRACR2ASMN1; SMN2MEN1
SCHEMBL6618133 0.90 RAB9A (0.41) RAB9ANPC1CRACR2ASMN1; SMN2MEN1
SCHEMBL6617319 0.89 RAB9A (0.40) RAB9ANPC1CRACR2ASMN1; SMN2MEN1
SCHEMBL6603511 0.87 MEN1 (0.39) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL6614537 0.86 ACKR3 (0.41) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL6615076 0.86 RAB9A (0.39) RAB9ANPC1CRACR2ASMN1; SMN2MEN1
SCHEMBL6618316 0.86 MAPT (0.42) RAB9ACRACR2ASMN1; SMN2MAPTTP53
SCHEMBL6621026 0.85 CRACR2A (0.46) CRACR2ASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL6604618 0.85 RAB9A (0.40) RAB9ANPC1CRACR2ASMN1; SMN2MEN1
SCHEMBL6622810 0.85 SMN1; SMN2 (0.42) RAB9ANPC1SMN1; SMN2MEN1KMT2A

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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