SCHEMBL11825039

SCHEMBL11825039

O=C(O)c1cc(SCc2cccc(C(F)(F)F)c2)cc(C(F)(F)F)c1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ DAO P14920 2/20 0.53
▸ NR4A2 P43354 2/20 0.51
▸ EPHX1 P07099 6/20 0.50
▸ SRD5A2 P31213 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.48
▸ GFER P55789 2/20 0.47
▸ MRGPRX4 Q96LA9 2/20 0.47
▸ POLB P06746 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ CES2 O00748 1/20 0.45
▸ PLA2G1B P04054 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ ATG4B Q9Y4P1 1/20 0.45

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
SCHEMBL11820578 0.91 ALDH1A1 (0.45) DAONR4A2SRD5A2ALDH1A1MRGPRX4
SCHEMBL11821945 0.87 DAO (0.47) DAONR4A2EPHX1SRD5A2ALDH1A1
SCHEMBL11820145 0.85 MEN1 (0.46) ALDH1A1POLBGAAPLA2G1BMAPT
SCHEMBL11815653 0.82 LMNA (0.56) DAOALDH1A1MRGPRX4POLBPLA2G1B
SCHEMBL13319445 0.78 DAO (0.57) DAOEPHX1ALDH1A1GFER
SCHEMBL11818505 0.78 MEN1 (0.43) SRD5A2ALDH1A1POLBMAPT
SCHEMBL11819492 0.77 DAO (0.43) DAOSRD5A2ALDH1A1MRGPRX4POLB
SCHEMBL11817250 0.77 NR4A2 (0.52) DAONR4A2EPHX1SRD5A2ALDH1A1
SCHEMBL11770007 0.76 POLB (0.50) SRD5A2ALDH1A1POLBGAAMAPT
SCHEMBL3892638 0.75 ALDH1A1 (0.58) DAOEPHX1ALDH1A1POLBGAA

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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