SCHEMBL13461192

SCHEMBL13461192

CCCCCCCCCCCCCCCc1cccc(OP(=S)(Cc2ccccc2)Oc2ccccc2)c1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 8/20 0.53
▸ PPARG P37231 5/20 0.53
▸ LPL P06858 2/20 0.43
▸ LIPG Q9Y5X9 2/20 0.43
▸ CETP P11597 1/20 0.42
▸ PLK1 P53350 1/20 0.41
▸ KCNH2 Q12809 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
SCHEMBL13400258 0.91 PPARA (0.56) PPARAPPARGLPLLIPGCETP
SCHEMBL6429074 0.91 PPARA (0.56) PPARAPPARGLPLLIPGCETP
SCHEMBL6429150 0.86 PPARA (0.56) PPARAPPARGLPLLIPGPLK1
SCHEMBL13461217 0.83 PPARA (0.45) PPARAPPARG
SCHEMBL23085167 0.77 PPARA (0.62) PPARAPPARGLPLLIPGCETP
SCHEMBL29959530 0.77 PPARA (0.62) PPARAPPARGLPLLIPGCETP
SCHEMBL10624215 0.77 PPARA (0.62) PPARAPPARGLPLLIPGCETP
SCHEMBL2874471 0.77 PPARA (0.62) PPARAPPARGLPLLIPGCETP
SCHEMBL10901221 0.77 PPARA (0.56) PPARAPPARGPLK1
SCHEMBL448634 0.76 PPARA (0.52) PPARAPPARGCETP

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-2169016-A1 Phase change inks Xerox Corporation (US) 2010-03-31 — — EP disclosed
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