SCHEMBL636061

SCHEMBL636061

CO[C@H]1C[C@](C)(C(=O)O)C[C@@H]1O

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 1/20 0.39
APLNR P35414 1/20 0.31

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
SCHEMBL637168 1.00 FFAR3 (0.39) FFAR3APLNR
SCHEMBL2410423 1.00 FFAR3 (0.39) FFAR3APLNR
SCHEMBL637102 0.80 FFAR3 (0.52) FFAR3APLNR
SCHEMBL636663 0.80 FFAR3 (0.52) FFAR3APLNR
SCHEMBL17923843 0.80 FFAR3 (0.52) FFAR3APLNR
SCHEMBL635702 0.79 FFAR3 (0.35) FFAR3
SCHEMBL12297657 0.76 FFAR3 (0.48) FFAR3APLNR
SCHEMBL25554207 0.74 FFAR3 (0.46) FFAR3APLNR
SCHEMBL636593 0.73 GSR (0.39) FFAR3
SCHEMBL2410553 0.73 GSR (0.39) FFAR3

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-8119806-B2 Cicletanine derivatives MERCK SHARP & DOHME CORP. (US) 2012-02-21 US disclosed