SCHEMBL7190361

SCHEMBL7190361

Sc1ccccc1S.c1cc2cc-2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
ESR1 P03372 1/20 0.43
KMT2A Q03164 1/20 0.43
MAOA P21397 1/20 0.42
APP P05067 1/20 0.42
KMO O15229 1/20 0.41
ALDH1A1 P00352 1/20 0.39
CYP3A4 P08684 2/20 0.39
CYP2C9 P11712 2/20 0.39
CYP1A1 P04798 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2E1 P05181 1/20 0.39
CYP2C8 P10632 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2A6 P11509 1/20 0.39
CYP4B1 P13584 1/20 0.39
CYP2B6 P20813 1/20 0.39
CYP3A5 P20815 1/20 0.39
CYP2A7 P20853 1/20 0.39
CYP3A7 P24462 1/20 0.39

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
Benzenethiol SCHEMBL3895266 0.89 MAOA (0.41) MEN1ESR1KMT2AMAOAAPP
SCHEMBL3891571 0.82 MAOA (0.44) MEN1ESR1KMT2AMAOAKMO
SCHEMBL28639034 0.80 MEN1 (0.45) MEN1ESR1KMT2AMAOAKMO
SCHEMBL4969576 0.79
SCHEMBL63240 0.79
SCHEMBL16582039 0.79 MAPT (0.45) MEN1KMT2AMAOAALDH1A1CYP3A4
SCHEMBL29365040 0.79
SCHEMBL2731883 0.76 ALDH1A1 (0.69) MEN1ESR1KMT2AMAOAAPP
SCHEMBL31734209 0.76 ALDH1A1 (0.69) MEN1ESR1KMT2AMAOAAPP
SCHEMBL2401076 0.76 ALDH1A1 (0.69) MEN1ESR1KMT2AMAOAAPP

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6586376-B1 Sterically hindered polyol ester and polyphenyl thioether, oxidation resistance; jet turbine engines EXXONMOBIL RESEARCH AND ENGINEERING COMPANY 2003-07-01 US disclosed
US-6191080-B1 MIXTURE OF POLYOL ESTERS, MIXTURE OF POLYPHENYLENE ETHER AND POLYOL ESTER AND POLYPHENYLENE THIOETHERS TONEN CORPORATION (JP) 2001-02-20 US disclosed
EP-0778334-A1 HEAT-RESISTANT LUBRICATING OIL COMPOSITION Tonen Corporation (JP) 1997-06-11 EP disclosed