SCHEMBL2316150

SCHEMBL2316150

O=C(O)C[C@H](Cc1ccc(Cl)c(Cl)c1)NC(=O)Cc1cccc(C(F)(F)F)c1

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 6/20 0.71
PIN1 Q13526 1/20 0.58
MME P08473 4/20 0.57
LMNA P02545 1/20 0.50
MEN1 O00255 1/20 0.49
MAPT P10636 1/20 0.49
KMT2A Q03164 1/20 0.49
MMEL1 Q495T6 3/20 0.46
HDAC1 Q13547 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
CSNK1D P48730 1/20 0.44
DDR1 Q08345 1/20 0.44
SIGMAR1 Q99720 1/20 0.44

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
SCHEMBL2316158 1.00 FFAR2 (0.71) FFAR2PIN1MMELMNAMEN1
SCHEMBL2317635 1.00 FFAR2 (0.71) FFAR2PIN1MMELMNAMEN1
SCHEMBL2317644 1.00 FFAR2 (0.71) FFAR2PIN1MMELMNAMEN1
SCHEMBL2312580 0.91 FFAR2 (0.72) FFAR2PIN1MMELMNAMEN1
SCHEMBL2312583 0.91 FFAR2 (0.72) FFAR2PIN1MMELMNAMEN1
SCHEMBL2319384 0.89 FFAR2 (0.80) FFAR2PIN1MMELMNAMEN1
SCHEMBL2319383 0.89 FFAR2 (0.80) FFAR2PIN1MMELMNAMEN1
SCHEMBL2316618 0.88 FFAR2 (0.82) FFAR2PIN1MMEMEN1MAPT
SCHEMBL2316614 0.88 FFAR2 (0.82) FFAR2PIN1MMEMEN1MAPT
SCHEMBL2318899 0.88 FFAR2 (0.82) FFAR2PIN1MMEMEN1MAPT

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