SCHEMBL10381663

SCHEMBL10381663

CCCCCc1ccc(C(=O)Oc2ccc(CCC)c(F)c2F)c(F)c1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RARB P10826 3/20 0.47
RARA P10276 1/20 0.47
RARG P13631 1/20 0.47
PPARA Q07869 2/20 0.45
PPARG P37231 1/20 0.45
S1PR1 P21453 1/20 0.40
KAT8 Q9H7Z6 2/20 0.40
THRB P10828 2/20 0.38
THRA P10827 1/20 0.38
FAAH O00519 1/20 0.38

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
SCHEMBL10382229 0.99 RARB (0.49) RARBRARARARGPPARAPPARG
SCHEMBL10383062 0.96 RARB (0.48) RARBRARARARGPPARAPPARG
SCHEMBL10383006 0.95 RARB (0.50) RARBRARARARGPPARAPPARG
SCHEMBL10382994 0.95 RARB (0.50) RARBRARARARGPPARAPPARG
SCHEMBL10381650 0.95 RARB (0.50) RARBRARARARGPPARAPPARG
SCHEMBL10381822 0.95 RARB (0.50) RARBRARARARGPPARAPPARG
SCHEMBL10381666 0.95 RARB (0.50) RARBRARARARGPPARAPPARG
SCHEMBL10381821 0.95 RARB (0.44) RARBRARARARGPPARAPPARG
SCHEMBL10381648 0.95 RARB (0.50) RARBRARARARGPPARAPPARG
SCHEMBL10382610 0.95 RARB (0.50) RARBRARARARGPPARAPPARG

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
US-4897216-A 2,3-difluorophenol derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1990-01-30 US disclosed