SCHEMBL2317495

SCHEMBL2317495

O=C(O)CC(Cc1ccc(C(F)(F)F)cc1)NC(=O)Cc1cccs1

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 4/20 0.65
MME P08473 8/20 0.56
RAB9A P51151 2/20 0.51
NPC1 O15118 1/20 0.51
POLB P06746 2/20 0.49
PKM P14618 1/20 0.48
MMEL1 Q495T6 1/20 0.46
HPGD P15428 2/20 0.45
CNR2 P34972 1/20 0.45
PIN1 Q13526 1/20 0.45

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
SCHEMBL2317493 1.00 FFAR2 (0.65) FFAR2MMERAB9ANPC1POLB
SCHEMBL2312665 0.86 FFAR2 (0.74) FFAR2MMECNR2PIN1
SCHEMBL2312671 0.86 FFAR2 (0.74) FFAR2MMECNR2PIN1
SCHEMBL2316365 0.86 FFAR2 (0.74) FFAR2MMECNR2PIN1
SCHEMBL2314791 0.86 HPGD (0.60) FFAR2MMERAB9ANPC1POLB
SCHEMBL2319212 0.86 MME (0.62) FFAR2MMERAB9ANPC1POLB
SCHEMBL2314782 0.86 HPGD (0.60) FFAR2MMERAB9ANPC1POLB
SCHEMBL2319208 0.86 MME (0.62) FFAR2MMERAB9ANPC1POLB
SCHEMBL2364855 0.85 FFAR2 (0.77) FFAR2MMECNR2PIN1
SCHEMBL2364853 0.85 FFAR2 (0.77) FFAR2MMECNR2PIN1

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-2011092284-A1 NOVEL AMINO ACID DERIVATIVES AND THEIR USE AS GPR43 RECEPTOR MODULATORS EUROSCREEN S.A. (BE) 2011-08-04 WO claimed