SCHEMBL382407

SCHEMBL382407

CC(C)(C)c1cc(-c2cc(-c3ccc(OC(=O)O)cc3)ccc2CCCO)ccc1N1CCCC1

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RARG P13631 16/20 0.60
RARA P10276 15/20 0.60
RARB P10826 15/20 0.60
S1PR1 P21453 1/20 0.36
POLB P06746 1/20 0.35
RBP4 P02753 1/20 0.34

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
SCHEMBL382731 0.88 RARG (0.73) RARGRARARARBS1PR1RBP4
SCHEMBL382310 0.86 RARG (0.80) RARGRARARARB
SCHEMBL382355 0.85 RARG (0.80) RARGRARARARB
SCHEMBL382051 0.84 RARA (0.60) RARGRARARARB
SCHEMBL383438 0.83 RARG (0.78) RARGRARARARB
SCHEMBL382222 0.79 RARG (0.66) RARGRARARARBPOLB
SCHEMBL382215 0.79 RARG (0.77) RARGRARARARB
SCHEMBL382434 0.78 RARG (0.64) RARGRARARARB
SCHEMBL382688 0.78 RARG (0.64) RARGRARARARB
SCHEMBL382619 0.77 RARG (0.78) RARGRARARARB

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