SCHEMBL11818503

SCHEMBL11818503

O=C(O)c1cc(OC(F)(F)F)ccc1SCc1ccc(C(F)(F)F)cc1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 11/20 0.45
▸ PPARD Q03181 8/20 0.45
▸ PPARG P37231 8/20 0.45
▸ CHRM5 P08912 1/20 0.44
▸ FKBP1A P62942 1/20 0.42
▸ KCNK2 O95069 1/20 0.42
▸ KCNK10 P57789 1/20 0.42
▸ IGF2BP2 Q9Y6M1 1/20 0.41
▸ TRPV1 Q8NER1 1/20 0.40
▸ EPHX1 P07099 1/20 0.40
▸ MRGPRX4 Q96LA9 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
SCHEMBL11820339 0.89 IGF2BP2 (0.46) PPARAPPARDKCNK2KCNK10IGF2BP2
SCHEMBL11829021 0.88 PPARD (0.43) PPARAPPARDKCNK2KCNK10IGF2BP2
SCHEMBL11818371 0.88 PTPRG (0.44) PPARAPPARDKCNK2KCNK10IGF2BP2
SCHEMBL11814817 0.88 PTPRG (0.48) PPARAPPARDKCNK2KCNK10EPHX1
SCHEMBL10744475 0.83 PPARD (0.49) PPARAPPARDPPARGFKBP1ATRPV1
SCHEMBL11822454 0.80 KDM5A (0.43) PPARAPPARDPPARGIGF2BP2EPHX1
SCHEMBL10746094 0.79 FKBP1A (0.53) PPARAPPARDPPARGFKBP1A
SCHEMBL11819449 0.79 CYP1A2 (0.48) CHRM5EPHX1MRGPRX4
SCHEMBL11818931 0.79 FKBP1A (0.50) PPARAPPARDPPARGFKBP1AMRGPRX4
SCHEMBL11825095 0.78 FKBP1A (0.52) PPARAPPARDPPARGFKBP1A

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-3954994-A Intermediates for preparing hipolipemic agents and method of lowering the blood lipid level in mammals with said agents PFIZER INC. (US) 1976-05-04 — — US disclosed
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