SCHEMBL11818557

SCHEMBL11818557

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

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FKBP1A P62942 1/20 0.47
▸ KDM1A O60341 3/20 0.43
▸ PPARD Q03181 1/20 0.41
▸ KCNQ3 O43525 1/20 0.40
▸ KCNQ2 O43526 1/20 0.40
▸ CA2 P00918 3/20 0.40
▸ CA4 P22748 1/20 0.40
▸ BCHE P06276 1/20 0.39
▸ ACHE P22303 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ PTPRG P23470 1/20 0.38
▸ CES2 O00748 1/20 0.38
▸ SORT1 Q99523 1/20 0.37
▸ ACLY P53396 1/20 0.37
▸ PTPRZ1 P23471 1/20 0.37
▸ PPARG P37231 2/20 0.37
▸ PPARA Q07869 2/20 0.37

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
SCHEMBL11814899 0.93 PPARD (0.43) FKBP1AKDM1APPARDCA2CA4
SCHEMBL11821491 0.85 MEN1 (0.45) KCNQ3KCNQ2CA2CA4ALDH1A1
SCHEMBL11820018 0.84 CA2 (0.53) CA2CA4ALDH1A1PTPRGCA12
SCHEMBL10746094 0.83 FKBP1A (0.53) FKBP1APPARDKCNQ3KCNQ2CA2
SCHEMBL11817140 0.83 CA2 (0.42) FKBP1ACA2CA4ALDH1A1PTPRG
SCHEMBL11817917 0.83 PTPRG (0.47) KDM1ACA2CA4HPGDPTPRG
SCHEMBL11817749 0.83 PTPRG (0.44) KDM1ACA2CA4ALDH1A1PTPRG
SCHEMBL11838590 0.83 LMNA (0.40) CA2CA4KDM4EALDH1A1HPGD
SCHEMBL11818931 0.83 FKBP1A (0.50) FKBP1APPARDKDM4EALDH1A1HPGD
SCHEMBL11825095 0.82 FKBP1A (0.52) FKBP1APPARDKCNQ3KCNQ2CA2

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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