SCHEMBL1100592

SCHEMBL1100592

CCOCCOc1cc(C)c(-c2cccc(COc3ccc(C=C(C)C(=O)O)cc3)c2)c(C)c1

nearest known ligand 0.69

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 20/20 0.69

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
SCHEMBL1100590 1.00 FFAR1 (0.69) FFAR1
SCHEMBL3606804 0.86 FFAR1 (0.70) FFAR1
SCHEMBL3606799 0.86 FFAR1 (0.70) FFAR1
SCHEMBL12577917 0.85 FFAR1 (0.69) FFAR1
SCHEMBL1100588 0.83 FFAR1 (0.66) FFAR1
SCHEMBL5114840 0.82 FFAR1 (1.00) FFAR1
SCHEMBL5113518 0.80 FFAR1 (0.72) FFAR1
SCHEMBL12578512 0.79 FFAR1 (0.71) FFAR1
SCHEMBL5101876 0.79 FFAR1 (0.82) FFAR1
SCHEMBL1101317 0.78 FFAR1 (0.71) FFAR1

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-8153694-B2 Cyclopropanecarboxylic acid compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-04-10 US disclosed