SCHEMBL22668348

SCHEMBL22668348

N=C(COc1ccc(COc2cc(F)c(CCC(=O)O)cc2F)cc1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 15/20 0.47
FFAR4 Q5NUL3 8/20 0.47
RXRG P48443 2/20 0.46
RXRA P19793 1/20 0.46
RXRB P28702 1/20 0.46
PTGER4 P35408 2/20 0.42
PTGER3 P43115 2/20 0.42
AKR1B1 P15121 2/20 0.42
PTGER1 P34995 1/20 0.41
PTGER2 P43116 1/20 0.41

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
SCHEMBL22668354 0.89 FFAR1 (0.53) FFAR1FFAR4PTGER4PTGER3AKR1B1
SCHEMBL459360 0.85 FFAR1 (0.57) FFAR1FFAR4RXRGRXRARXRB
SCHEMBL459361 0.85 FFAR1 (0.57) FFAR1FFAR4RXRGRXRARXRB
SCHEMBL22668112 0.83 FFAR1 (0.54) FFAR1FFAR4PTGER4PTGER3AKR1B1
SCHEMBL22668067 0.81 FFAR1 (0.72) FFAR1FFAR4AKR1B1
SCHEMBL22668108 0.80 FFAR1 (0.56) FFAR1FFAR4PTGER4PTGER3AKR1B1
SCHEMBL22668107 0.78 APP (0.55) FFAR1FFAR4
SCHEMBL22668435 0.78 FFAR1 (0.48) FFAR1FFAR4AKR1B1
SCHEMBL22668391 0.77 FFAR1 (0.46) FFAR1FFAR4
SCHEMBL433653 0.76 FFAR1 (0.51) FFAR1FFAR4RXRGRXRARXRB

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
EP-2595952-B1 AGONISTS OF GPR40 CONNEXIOS LIFE SCIENCES PVT LTD (IN) 2020-11-18 EP disclosed