SCHEMBL382276

SCHEMBL382276

CC(C)(C)c1cc(-c2cc(-c3ccc(OC(=O)O)nc3)ccc2OCCO)ccc1N1CCCC1

nearest known ligand 0.73

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RARG P13631 15/20 0.73
RARB P10826 14/20 0.73
RARA P10276 13/20 0.73
PDE2A O00408 2/20 0.35
PDE4B Q07343 2/20 0.35
SLC6A9 P48067 2/20 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
SCHEMBL382275 0.88 RARG (0.77) RARGRARBRARA
SCHEMBL383438 0.87 RARG (0.78) RARGRARBRARASLC6A9
SCHEMBL382310 0.85 RARG (0.80) RARGRARBRARASLC6A9
Trifarotene SCHEMBL381493 0.84 RARG (1.00) RARGRARBRARA
SCHEMBL382355 0.84 RARG (0.80) RARGRARBRARASLC6A9
SCHEMBL29763755 0.84 RARG (0.81) RARGRARBRARASLC6A9
SCHEMBL382411 0.83 RARG (0.98) RARGRARBRARA
SCHEMBL382592 0.83 RARG (0.69) RARGRARBRARASLC6A9
SCHEMBL27337609 0.82 RARG (0.85) RARGRARBRARA
SCHEMBL26199872 0.82 RARG (0.78) RARGRARBRARASLC6A9

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