SCHEMBL382355

SCHEMBL382355

CC(C)(C)c1cc(-c2cc(-c3ccc(OC(=O)O)cc3)ccc2OCCCCO)ccc1N1CCCC1

nearest known ligand 0.80

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
RARG P13631 18/20 0.80
RARB P10826 17/20 0.80
RARA P10276 16/20 0.80
SLC6A9 P48067 1/20 0.36

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
SCHEMBL382310 0.97 RARG (0.80) RARGRARBRARASLC6A9
SCHEMBL383438 0.95 RARG (0.78) RARGRARBRARASLC6A9
SCHEMBL382857 0.91 RARG (0.80) RARGRARBRARA
SCHEMBL382479 0.89 RARG (1.00) RARGRARBRARA
SCHEMBL382434 0.89 RARG (0.64) RARGRARBRARA
SCHEMBL382222 0.89 RARG (0.66) RARGRARBRARASLC6A9
SCHEMBL382688 0.87 RARG (0.64) RARGRARBRARASLC6A9
SCHEMBL382843 0.86 RARG (1.00) RARGRARBRARA
SCHEMBL382741 0.86 RARG (0.83) RARGRARBRARA
SCHEMBL382407 0.85 RARG (0.60) 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