SCHEMBL11549783

SCHEMBL11549783

CN(C)/C=C(/C(=O)Cc1ccccc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CES2 O00748 2/20 0.52
▸ CES1 P23141 2/20 0.52
▸ FNTA P49354 1/20 0.44
▸ FNTB P49356 1/20 0.44
▸ AKR1B1 P15121 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ KMT2A Q03164 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ GPR52 Q9Y2T5 1/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ CASP3 P42574 1/20 0.39
▸ SENP8 Q96LD8 1/20 0.39
▸ SENP7 Q9BQF6 1/20 0.39
▸ SENP6 Q9GZR1 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ PAM P19021 1/20 0.39
▸ CA12 O43570 1/20 0.39
▸ CA9 Q16790 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
SCHEMBL11549787 1.00 CES2 (0.52) CES2CES1FNTAFNTBAKR1B1
SCHEMBL11478436 0.84 GPR52 (0.50) CES2CES1KMT2AMEN1GPR52
SCHEMBL11478439 0.84 GPR52 (0.50) CES2CES1KMT2AMEN1GPR52
SCHEMBL2373777 0.83 CES2 (0.53) CES2CES1RECQLKMT2ANPC1
SCHEMBL2373780 0.83 CES2 (0.53) CES2CES1RECQLKMT2ANPC1
SCHEMBL27580565 0.81 RECQL (0.43) CES2CES1RECQLKMT2AMEN1
SCHEMBL28349093 0.81 AKT1 (0.43) RECQLKMT2AMEN1RAB9A
SCHEMBL2373805 0.80 CES2 (0.56) CES2CES1RECQLKMT2ATDP1
SCHEMBL2373801 0.80 CES2 (0.56) CES2CES1RECQLKMT2ATDP1
SCHEMBL11880987 0.79 CES1 (0.59) CES2CES1FNTAFNTBAKR1B1

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-4152136-A HERBICIDES ELI LILLY AND COMPANY (US) 1979-05-01 — — US disclosed
Send feedback