SCHEMBL382683

SCHEMBL382683

CCN(CC)c1ccc(-c2cc(-c3ccc(OC(=O)O)cc3)ccc2CC(O)CO)cc1C(C)(C)C

nearest known ligand 0.78

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RARG P13631 17/20 0.78
RARB P10826 16/20 0.78
RARA P10276 14/20 0.78
SCN9A Q15858 2/20 0.33
LMNA P02545 1/20 0.31
GAA P10253 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
SCHEMBL382466 0.88 RARG (1.00) RARGRARBRARA
SCHEMBL382215 0.85 RARG (0.77) RARGRARBRARA
SCHEMBL382587 0.84 RARA (0.80) RARGRARBRARA
SCHEMBL382960 0.82 RARB (0.56) RARGRARBRARAGAA
SCHEMBL382732 0.82 RARG (0.65) RARGRARBRARALMNAGAA
SCHEMBL383570 0.80 RARG (0.62) RARGRARBRARA
SCHEMBL381528 0.80 RARG (0.79) RARGRARBRARA
SCHEMBL382828 0.80 RARG (0.61) RARGRARBRARALMNA
SCHEMBL383242 0.79 RARG (0.79) RARGRARBRARA
SCHEMBL382183 0.78 RARG (0.80) RARGRARBRARA

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-1831149-B1 NOVEL LIGANDS THAT MODULATE RAR RECEPTORS AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RES & DEV (FR) 2012-01-25 EP claimed