SCHEMBL7972214

SCHEMBL7972214

C=C/C=C(\C=C(\C)N)c1ccc(NC(=O)Nc2cc(Cl)ccc2F)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.44
▸ MEN1 O00255 5/20 0.44
▸ KMT2A Q03164 5/20 0.44
▸ HTT P42858 4/20 0.44
▸ KDR P35968 4/20 0.44
▸ CA12 O43570 2/20 0.43
▸ CA1 P00915 2/20 0.43
▸ CA2 P00918 2/20 0.43
▸ CA9 Q16790 2/20 0.43
▸ GRIK1 P39086 4/20 0.43
▸ SMN1; SMN2 Q16637 5/20 0.42
▸ RAB9A P51151 5/20 0.42
▸ NPC1 O15118 4/20 0.42
▸ NLRP1 Q9C000 1/20 0.42
▸ CASP3 P42574 1/20 0.41
▸ SENP7 Q9BQF6 1/20 0.41
▸ HDAC1 Q13547 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ NFKB1 P19838 1/20 0.39
▸ NFKB2 Q00653 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
SCHEMBL7972209 0.91 CA12 (0.51) MAPTMEN1KMT2AHTTKDR
SCHEMBL7971214 0.91 SMN1; SMN2 (0.46) MAPTMEN1KMT2AHTTKDR
SCHEMBL7971235 0.90 MAPT (0.45) MAPTMEN1KMT2AHTTCA12
SCHEMBL7972711 0.90 RAB9A (0.53) MAPTKDRSMN1; SMN2RAB9ANPC1
SCHEMBL7968137 0.87 KDR (0.61) KDRCA12CA1CA2CA9
SCHEMBL7968477 0.86 KDR (0.41) MAPTMEN1KMT2AHTTKDR
SCHEMBL7975277 0.86 RAB9A (0.55) MAPTMEN1KMT2AHTTKDR
SCHEMBL7969844 0.81 RAB9A (0.47) MAPTMEN1KMT2AHTTKDR
SCHEMBL7972714 0.80 MEN1 (0.50) MAPTMEN1KMT2AKDRCA12
SCHEMBL7968563 0.80 RAB9A (0.55) MAPTMEN1KMT2ACA12CA1

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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