SCHEMBL11818931

SCHEMBL11818931

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

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FKBP1A P62942 1/20 0.50
▸ PTPRG P23470 3/20 0.47
▸ PTPRC P08575 2/20 0.47
▸ PPARD Q03181 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ CES2 O00748 1/20 0.41
▸ MPO P05164 1/20 0.41
▸ SORT1 Q99523 1/20 0.40
▸ CDK2 P24941 1/20 0.40
▸ LIPC P11150 1/20 0.40
▸ LIPG Q9Y5X9 1/20 0.40
▸ TAS2R14 Q9NYV8 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ PPARG P37231 3/20 0.39
▸ PPARA Q07869 3/20 0.39
▸ MRGPRX4 Q96LA9 1/20 0.39
▸ GRIK1 P39086 1/20 0.39

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 0.88 FKBP1A (0.53) FKBP1APTPRGPTPRCPPARDKDM4E
SCHEMBL11820125 0.86 FKBP1A (0.52) FKBP1APTPRGPTPRCPPARDKDM4E
Ammonia Solution, Strong SCHEMBL11820558 0.86 FKBP1A (0.52) FKBP1APTPRGPTPRCPPARDKDM4E
SCHEMBL11819040 0.86 FKBP1A (0.52) FKBP1APTPRGPTPRCPPARDKDM4E
SCHEMBL11825095 0.86 FKBP1A (0.52) FKBP1APTPRGPTPRCPPARDKDM4E
SCHEMBL11821280 0.86 FKBP1A (0.52) FKBP1APTPRGPTPRCPPARDKDM4E
SCHEMBL11821844 0.86 FKBP1A (0.52) FKBP1APTPRGPTPRCPPARDKDM4E
SCHEMBL10744475 0.84 PPARD (0.49) FKBP1APPARDHPGDPPARGPPARA
SCHEMBL11823732 0.83 GFER (0.54) FKBP1AALDH1A1HPGDLMNA
SCHEMBL11818557 0.83 FKBP1A (0.47) FKBP1APTPRGPPARDKDM4EALDH1A1

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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