SCHEMBL7782879

SCHEMBL7782879

CCOCn1c(S(=O)(=O)c2ccc(Cl)c(Cl)c2)cc(C#N)c1-c1ccc(Cl)cc1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.38
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
CNR1 P21554 2/20 0.34
CHRNA7 P36544 2/20 0.33
MAPT P10636 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
PGR P06401 4/20 0.32
PTGS1 P23219 2/20 0.32
PTGS2 P35354 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
SCN9A Q15858 1/20 0.32
DUT P33316 1/20 0.32
KDM2B Q8NHM5 1/20 0.31

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
SCHEMBL7782871 0.93 ALDH1A1 (0.38) ALDH1A1KDM4EGAACNR1CHRNA7
SCHEMBL7786310 0.92 GRM5 (0.35) ALDH1A1KDM4EGAACNR1CHRNA7
SCHEMBL7784877 0.85 ALDH1A1 (0.39) ALDH1A1KDM4EGAAMAPTCA12
SCHEMBL7784777 0.76 KDM4E (0.33) ALDH1A1KDM4EGAACNR1MAPT
SCHEMBL7777931 0.75 MAOA (0.38) ALDH1A1KDM4EGAACNR1MAPT
SCHEMBL7784924 0.74 MAPT (0.39) ALDH1A1GAACHRNA7MAPTCA9
SCHEMBL7786278 0.73 GRM5 (0.33) ALDH1A1KDM4ECHRNA7CA12CA1
SCHEMBL8532395 0.71 KDM4E (0.38) ALDH1A1KDM4EGAACNR1MAPT
Hydrochloric Acid SCHEMBL28752946 0.70 KDM4E (0.37) ALDH1A1KDM4EGAACNR1MAPT
SCHEMBL7784737 0.70 MAOA (0.42) ALDH1A1KDM4EGAACNR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0801058-B1 Arylthio, -sulfinyl and -sulfonyl pyrrole insecticidal agents AMERICAN CYANAMID CO (US) 2001-10-10 EP claimed
EP-0801058-A1 Arylthio, -sulfinyl and -sulfonyl pyrrole insecticidal agents American Cyanamid Company (US) 1997-10-15 EP claimed
EP-0801058-B1 Arylthio, -sulfinyl and -sulfonyl pyrrole insecticidal agents AMERICAN CYANAMID CO (US) 2001-10-10 EP disclosed
US-5817691-A Arylthio, -sulfinyl and -sulfonyl pyrrole insecticidal agents AMERICAN CYANAMID COMPANY (US) 1998-10-06 US disclosed
EP-0801058-A1 Arylthio, -sulfinyl and -sulfonyl pyrrole insecticidal agents American Cyanamid Company (US) 1997-10-15 EP disclosed