SCHEMBL382145

SCHEMBL382145

CCOC(=O)c1ccc(-c2ccc(CCCBr)cc2)cc1-c1ccc(N(CC)CC)c(C(C)(C)C)c1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RARB P10826 16/20 0.49
RARA P10276 14/20 0.49
RARG P13631 14/20 0.49
PGR P06401 1/20 0.35
CYP4F2 P78329 1/20 0.34
CYP4A11 Q02928 1/20 0.34
ERN1 O75460 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
SCHEMBL382277 0.83 RARA (0.66) RARBRARARARG
SCHEMBL383525 0.81 RARG (0.62) RARBRARARARGPGR
SCHEMBL380874 0.80 RARA (0.51) RARBRARARARGPGR
SCHEMBL4576607 0.79 RARB (0.60) RARBRARARARG
SCHEMBL382090 0.77 RARA (0.48) RARBRARARARGPGR
SCHEMBL382210 0.75 RARB (0.57) RARBRARARARG
SCHEMBL382630 0.75 RARG (0.79) RARBRARARARGCYP4F2CYP4A11
SCHEMBL381907 0.74 RARA (0.66) RARBRARARARG
SCHEMBL381583 0.74 RARA (0.68) RARBRARARARG
SCHEMBL381777 0.73 RARA (0.55) RARBRARARARG

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 disclosed