SCHEMBL11405473

SCHEMBL11405473

CCCCCc1cc(C(O)=S)co1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 1/20 0.39
PTGS2 P35354 4/20 0.35
CYP3A4 P08684 1/20 0.35
TYR P14679 1/20 0.34
ALOX5 P09917 1/20 0.34
PTGS1 P23219 1/20 0.34
TRPV1 Q8NER1 1/20 0.34
EPHX2 P34913 1/20 0.33
ALOX15 P16050 1/20 0.33
ELANE P08246 1/20 0.33

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
SCHEMBL11407867 0.98 PPARA (0.41) PPARAPTGS2CYP3A4ALOX5PTGS1
SCHEMBL11398250 0.95 PPARA (0.34) PPARACYP3A4TYRALOX5
SCHEMBL2911934 0.83 L3MBTL1 (0.47) PPARA
SCHEMBL3923663 0.72 MAPT (0.41) PPARAPTGS2CYP3A4TYRALOX15
SCHEMBL9769164 0.71 MAPT (0.44) PPARAPTGS2CYP3A4ELANE
SCHEMBL18977711 0.70 SPHK2 (0.37) ALOX5
SCHEMBL9769157 0.69 MAPT (0.37) PPARAPTGS2CYP3A4TYRALOX5
SCHEMBL4676588 0.69 THRA (0.34) PPARAEPHX2
SCHEMBL4676591 0.69 THRA (0.34) PPARAEPHX2
SCHEMBL11397141 0.69 DAO (0.43) PTGS2CYP3A4TYRALOX5ALOX15

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-4282246-A Antidiabetic furancarboxylic and thiphenecarboxylic acids PFIZER INC. (US) 1981-08-04 US disclosed