SCHEMBL4968583

SCHEMBL4968583

CCCCCC(=O)N(C)Cc1cccc(-c2cc(CC)c(CC(C)C(=O)O)c(CC)c2)c1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 14/20 0.46
FOLH1 Q04609 1/20 0.41
PTGS2 P35354 1/20 0.41
PPARA Q07869 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL4969558 0.85 AOC3 (0.48) AOC3FOLH1NPC1RAB9A
SCHEMBL4968474 0.81 AOC3 (0.44) AOC3
SCHEMBL4969992 0.76 AOC3 (0.48) AOC3FOLH1NPC1RAB9A
SCHEMBL6184310 0.75 AOC3 (0.47) AOC3FOLH1
SCHEMBL6183287 0.75 AOC3 (0.47) AOC3FOLH1
SCHEMBL6184829 0.75 AOC3 (0.47) AOC3PPARA
SCHEMBL5567583 0.75 AOC3 (0.47) AOC3PPARA
SCHEMBL4968711 0.75 AOC3 (0.46) AOC3FOLH1NPC1RAB9A
SCHEMBL5361863 0.74 AOC3 (0.53) AOC3
SCHEMBL4971505 0.74 AOC3 (0.46) AOC3FOLH1

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-1781274-B1 NOVEL BIAROMATIC COMPOUNDS WHICH ACTIVATE RECEPTORS OF PPAR TYPE AND THEIR USE IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS GALDERMA RES & DEV (FR) 2008-11-05 EP claimed