SCHEMBL11818479

SCHEMBL11818479

O=C(O)c1cc(S(=O)(=O)C(F)(F)F)ccc1SCc1cccc(S(=O)(=O)C(F)(F)F)c1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 2/20 0.46
▸ CA4 P22748 1/20 0.46
▸ RXFP1 Q9HBX9 3/20 0.42
▸ PTPRG P23470 2/20 0.41
▸ AR P10275 1/20 0.40
▸ MRGPRX4 Q96LA9 1/20 0.40
▸ EPAS1 Q99814 1/20 0.40
▸ MCL1 Q07820 1/20 0.40
▸ BCL2A1 Q16548 1/20 0.40
▸ PTPRC P08575 2/20 0.39
▸ KCNQ3 O43525 1/20 0.39
▸ KCNQ2 O43526 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.38
▸ CCR2 P41597 1/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ P2RX1 P51575 1/20 0.36

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
SCHEMBL11820018 0.93 CA2 (0.53) CA2CA4RXFP1PTPRGEPAS1
SCHEMBL11818248 0.91 CA2 (0.43) CA2CA4RXFP1PTPRGAR
SCHEMBL11821491 0.91 MEN1 (0.45) CA2CA4KCNQ3KCNQ2ALDH1A1
SCHEMBL11825522 0.88 ALDH1A1 (0.46) CA2CA4ALDH1A1MEN1KMT2A
SCHEMBL11816258 0.88 CYP1A2 (0.46) CA2CA4PTPRGEPAS1ALDH1A1
SCHEMBL11816465 0.88 KDM5A (0.41) CA2CA4RXFP1PTPRGAR
SCHEMBL11814899 0.84 PPARD (0.43) CA2CA4PTPRGEPAS1
SCHEMBL11817140 0.84 CA2 (0.42) CA2CA4RXFP1PTPRGEPAS1
SCHEMBL11817749 0.84 PTPRG (0.44) CA2CA4RXFP1PTPRGEPAS1
SCHEMBL11817917 0.84 PTPRG (0.47) CA2CA4PTPRGARMRGPRX4

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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