SCHEMBL11825095

SCHEMBL11825095

O=C(O)c1cc(C(F)(F)F)ccc1SCc1ccccc1.[MgH2]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FKBP1A P62942 1/20 0.52
▸ PTPRC P08575 1/20 0.47
▸ PTPRG P23470 1/20 0.46
▸ PPARG P37231 5/20 0.45
▸ PPARA Q07869 5/20 0.45
▸ KCNQ3 O43525 1/20 0.44
▸ KCNQ2 O43526 1/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ SORT1 Q99523 3/20 0.44
▸ GFER P55789 1/20 0.44
▸ CES2 O00748 1/20 0.43
▸ PPARD Q03181 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ CA2 P00918 1/20 0.42

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
SCHEMBL10746094 0.99 FKBP1A (0.53) FKBP1APTPRCPTPRGPPARGPPARA
SCHEMBL11821280 0.97 FKBP1A (0.52) FKBP1APTPRCPTPRGPPARGPPARA
Ammonia Solution, Strong SCHEMBL11820558 0.97 FKBP1A (0.52) FKBP1APTPRCPTPRGPPARGPPARA
SCHEMBL11821844 0.97 FKBP1A (0.52) FKBP1APTPRCPTPRGPPARGPPARA
SCHEMBL11820125 0.97 FKBP1A (0.52) FKBP1APTPRCPTPRGPPARGPPARA
SCHEMBL11819040 0.97 FKBP1A (0.52) FKBP1APTPRCPTPRGPPARGPPARA
SCHEMBL11823732 0.90 GFER (0.54) FKBP1AALDH1A1HPGDL3MBTL1GFER
SCHEMBL11821838 0.88 CA2 (0.44) FKBP1APTPRCPTPRGPPARGPPARA
SCHEMBL11814812 0.88 CA2 (0.51) FKBP1APTPRCKCNQ3KCNQ2ALDH1A1
SCHEMBL11820118 0.86 CA2 (0.43) FKBP1APTPRCPTPRGPPARGPPARA

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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