SCHEMBL382857

SCHEMBL382857

O=C(O)Oc1ccc(-c2ccc(OCCCCO)c(-c3ccc(N4CCCC4)c(C(F)(F)F)c3)c2)cc1

nearest known ligand 0.80

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RARG P13631 16/20 0.80
RARB P10826 15/20 0.80
RARA P10276 14/20 0.80
FAAH O00519 1/20 0.39
DRD3 P35462 1/20 0.39
TAAR1 Q96RJ0 1/20 0.37
NOTUM Q6P988 1/20 0.37

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
SCHEMBL382355 0.91 RARG (0.80) RARGRARBRARA
SCHEMBL382692 0.89 RARG (1.00) RARGRARBRARATAAR1
SCHEMBL382310 0.88 RARG (0.80) RARGRARBRARA
SCHEMBL383438 0.85 RARG (0.78) RARGRARBRARA
SCHEMBL382093 0.83 RARG (0.79) RARGRARBRARATAAR1
SCHEMBL383386 0.81 RARG (0.55) RARGRARBRARA
SCHEMBL382810 0.81 RARG (0.59) RARGRARBRARA
SCHEMBL382434 0.80 RARG (0.64) RARGRARBRARA
SCHEMBL382479 0.80 RARG (1.00) RARGRARBRARA
SCHEMBL382222 0.80 RARG (0.66) 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