SCHEMBL7639633

SCHEMBL7639633

C/C(=C\c1ccc(F)cc1)P(c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 1/20 0.44
PTGS2 P35354 1/20 0.41
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
KMT2A Q03164 1/20 0.41
TRPA1 O75762 7/20 0.39
ABCB11 O95342 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
PKM P14618 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
NPC1 O15118 1/20 0.36
MAPT P10636 1/20 0.36
NFKB1 P19838 1/20 0.36
RAB9A P51151 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TSHR P16473 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
SCHEMBL7639635 1.00 NFE2L2 (0.44) NFE2L2PTGS2MEN1POLBKMT2A
SCHEMBL15364425 0.87 ALDH1A1 (0.47) MEN1POLBKMT2ANPC1MAPT
SCHEMBL15364420 0.87 ALDH1A1 (0.47) MEN1POLBKMT2ANPC1MAPT
SCHEMBL26156777 0.69 TRPA1 (0.50) NFE2L2PTGS2MEN1KMT2ATRPA1
SCHEMBL2622602 0.69 NFE2L2 (0.61) NFE2L2TRPA1MAPTSMN1; SMN2ALDH1A1
SCHEMBL6937636 0.69 ESR1 (0.36) MEN1POLBKMT2AL3MBTL1NPC1
SCHEMBL12750946 0.67 CYP3A4 (0.35)
SCHEMBL15364362 0.67 GAA (0.43) MEN1POLBKMT2APKML3MBTL1
SCHEMBL6170114 0.67 MEN1 (0.62) PTGS2MEN1POLBKMT2ANPC1
SCHEMBL6170117 0.67 MEN1 (0.62) PTGS2MEN1POLBKMT2ANPC1

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
US-6455720-B1 AS CATALYSTS TAKASAGO INTERNATIONAL CORPORATION (JP) 2002-09-24 US disclosed