SCHEMBL7778209

SCHEMBL7778209

[O-][S+](c1ccccc1)c1c(-c2ccc(Cl)cc2)[nH]c(C(F)(F)F)c1Cl

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PSD A5PKW4 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ATM Q13315 1/20 0.34
CYP1A2 P05177 1/20 0.33
SERPINE1 P05121 1/20 0.31
MAPK14 Q16539 3/20 0.31
MAPK13 O15264 2/20 0.31
MAPK12 P53778 2/20 0.31
MAPK11 Q15759 2/20 0.31
GCGR P47871 2/20 0.31
RAF1 P04049 1/20 0.31
CCNB2 O95067 1/20 0.31
CDK1 P06493 1/20 0.31
CCNB1 P14635 1/20 0.31
CCNB3 Q8WWL7 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
SCHEMBL7778184 0.87 PSD (0.31) PSDMEN1KMT2AATMCYP1A2
SCHEMBL7782939 0.80 PSD (0.31) PSD
SCHEMBL7782874 0.75 MAPK14 (0.34) MEN1KMT2AATMCYP1A2SERPINE1
SCHEMBL7782851 0.70 TUBB4A (0.40) PSDMEN1KMT2AATMCYP1A2
SCHEMBL7782898 0.68 PSD (0.41) PSDMEN1KMT2A
SCHEMBL7784932 0.67 KDM4E (0.32) MEN1KMT2AMAPK14GCGR
SCHEMBL1180132 0.66 ALDH1A1 (0.48) PSDMEN1KMT2A
SCHEMBL197578 0.65 TSHR (0.48) MEN1KMT2ACYP1A2
SCHEMBL9015077 0.65 ABCC8 (0.47) PSDCYP1A2
SCHEMBL9015086 0.65 ABCC8 (0.47) PSDCYP1A2

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
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