SCHEMBL7975277

SCHEMBL7975277

C=C/C=C(\C=C(\C)N)c1ccc(NC(=O)Nc2ccccc2F)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 12/20 0.55
▸ NPC1 O15118 10/20 0.55
▸ SMN1; SMN2 Q16637 7/20 0.55
▸ HTT P42858 4/20 0.55
▸ MAPT P10636 3/20 0.55
▸ NFKB1 P19838 3/20 0.55
▸ NFKB2 Q00653 3/20 0.55
▸ RELA Q04206 3/20 0.55
▸ KDM4E B2RXH2 1/20 0.55
▸ POLB P06746 1/20 0.52
▸ PKM P14618 4/20 0.51
▸ CDK5 Q00535 1/20 0.51
▸ CDK5R1 Q15078 1/20 0.51
▸ KMT2A Q03164 3/20 0.50
▸ MEN1 O00255 2/20 0.50
▸ CA12 O43570 2/20 0.49
▸ CA1 P00915 2/20 0.49
▸ CA2 P00918 2/20 0.49
▸ CA9 Q16790 2/20 0.49
▸ CYP1A2 P05177 1/20 0.49

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
SCHEMBL7968918 0.88 RAB9A (0.54) RAB9ANPC1SMN1; SMN2HTTMAPT
SCHEMBL7971214 0.87 SMN1; SMN2 (0.46) RAB9ANPC1SMN1; SMN2HTTMAPT
SCHEMBL7967861 0.87 RAB9A (0.51) RAB9ANPC1SMN1; SMN2HTTMAPT
SCHEMBL7972214 0.86 MAPT (0.44) RAB9ANPC1SMN1; SMN2HTTMAPT
SCHEMBL7972711 0.86 RAB9A (0.53) RAB9ANPC1SMN1; SMN2MAPTPKM
SCHEMBL7966143 0.86 HTT (0.53) RAB9ANPC1SMN1; SMN2HTTMAPT
SCHEMBL7967421 0.86 KMT2A (0.54) RAB9ANPC1SMN1; SMN2MAPTKDM4E
SCHEMBL7977635 0.85 CA12 (0.51) RAB9ANPC1SMN1; SMN2MAPTPOLB
SCHEMBL7955588 0.85 CA12 (0.53) RAB9ANPC1SMN1; SMN2HTTMAPT
SCHEMBL7970330 0.85 RAB9A (0.64) RAB9ANPC1SMN1; SMN2MAPTPOLB

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009137404-A1 UREA COMPOUNDS AS GAMMA SECRETASE MODULATORS AMGEN INC. (US) 2009-11-12 — — WO disclosed
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