SCHEMBL11821491

SCHEMBL11821491

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

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ GFER P55789 2/20 0.44
▸ EPHX1 P07099 4/20 0.44
▸ CA2 P00918 2/20 0.43
▸ CA4 P22748 1/20 0.43
▸ NPSR1 Q6W5P4 4/20 0.42
▸ MAPT P10636 4/20 0.42
▸ L3MBTL1 Q9Y468 4/20 0.42
▸ HTT P42858 2/20 0.42
▸ HPGD P15428 2/20 0.42
▸ LMNA P02545 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ ALPG P10696 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ DAO P14920 2/20 0.42
▸ GAA P10253 2/20 0.41

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
SCHEMBL11816938 0.91 GFER (0.44) MEN1KMT2AGFEREPHX1CA2
SCHEMBL11818479 0.91 CA2 (0.46) MEN1KMT2ACA2CA4ALDH1A1
SCHEMBL11820018 0.88 CA2 (0.53) MEN1KMT2ACA2CA4L3MBTL1
SCHEMBL11814899 0.87 PPARD (0.43) CA2CA4L3MBTL1CA12CA1
SCHEMBL11818248 0.87 CA2 (0.43) MEN1KMT2ACA2CA4NPSR1
SCHEMBL11823732 0.86 GFER (0.54) GFEREPHX1NPSR1MAPTL3MBTL1
SCHEMBL11818557 0.85 FKBP1A (0.47) CA2CA4HPGDALDH1A1KCNQ3
SCHEMBL11816258 0.84 CYP1A2 (0.46) MEN1KMT2ACA2CA4HPGD
SCHEMBL11825522 0.84 ALDH1A1 (0.46) MEN1KMT2ACA2CA4MAPT
SCHEMBL11817917 0.81 PTPRG (0.47) MEN1KMT2ACA2CA4HTT

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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