SCHEMBL11355385

SCHEMBL11355385

COC(=O)C(C)[S+]([O-])c1cc(Oc2ccc(C(F)(F)F)cc2Cl)ccc1Cl

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 5/20 0.48
▸ HTR2A P28223 3/20 0.48
▸ SLC6A4 P31645 3/20 0.48
▸ KCNH2 Q12809 3/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ TTR P02766 1/20 0.48
▸ PPOX P50336 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ MAPK1 P28482 1/20 0.40
▸ MAPT P10636 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ SCN8A Q9UQD0 1/20 0.39
▸ SCN10A Q9Y5Y9 1/20 0.39
▸ MRGPRX4 Q96LA9 2/20 0.39
▸ PPARD Q03181 1/20 0.38
▸ PPARA Q07869 1/20 0.38

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
SCHEMBL11442480 0.79 FFAR1 (0.52) FFAR1HTR2ASLC6A4KCNH2MEN1
SCHEMBL11258317 0.78 FFAR1 (0.54) FFAR1HTR2ASLC6A4KCNH2MEN1
SCHEMBL732095 0.77 FFAR1 (0.58) FFAR1HTR2ASLC6A4KCNH2MEN1
SCHEMBL11236818 0.77 FFAR1 (0.50) FFAR1HTR2ASLC6A4KCNH2MEN1
SCHEMBL10822603 0.77 MEN1 (0.53) FFAR1HTR2ASLC6A4KCNH2MEN1
SCHEMBL11563835 0.76 FFAR1 (0.49) FFAR1HTR2ASLC6A4KCNH2MEN1
SCHEMBL9838509 0.76 TDP1 (0.51) FFAR1HTR2ASLC6A4KCNH2MEN1
SCHEMBL11440764 0.76 FFAR1 (0.49) FFAR1HTR2ASLC6A4KCNH2MEN1
SCHEMBL9838520 0.76 TDP1 (0.51) FFAR1HTR2ASLC6A4KCNH2MEN1
SCHEMBL9839768 0.76 TDP1 (0.51) FFAR1HTR2ASLC6A4KCNH2MEN1

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
EP-0000359-B1 PHENOXY-PHENYLSULFINYL-AND-SULFONYLALKANECARBOXYLIC ACID DERIVATIVES, METHOD FOR THEIR PREPARATION AND THEIR USE AS HERBICIDES AND PLANT GROWTH REGULATORS. CIBA-GEIGY AG (CH) 1981-10-21 — — EP disclosed
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