SCHEMBL8662791

SCHEMBL8662791

O=S(=O)(c1c(-c2ccc(Cl)cc2)[nH]c(C(F)(F)F)c1-c1ccccc1)C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PSD A5PKW4 8/20 0.41
PTGS2 P35354 5/20 0.39
ARF6 P62330 1/20 0.38
CYP1A2 P05177 1/20 0.35
KCNQ3 O43525 1/20 0.34
KCNQ2 O43526 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL7782898 0.75 PSD (0.41) PSDPTGS2KCNQ3KCNQ2L3MBTL1
SCHEMBL9446485 0.75 GRM5 (0.47) PSDCYP1A2
SCHEMBL9015077 0.74 ABCC8 (0.47) PSDPTGS2ARF6CYP1A2KCNQ3
SCHEMBL9015086 0.74 ABCC8 (0.47) PSDPTGS2ARF6CYP1A2KCNQ3
SCHEMBL7783642 0.73 ALDH1A1 (0.39) PSDPTGS2KCNQ3KCNQ2L3MBTL1
SCHEMBL1180312 0.71 PTGS2 (0.35) PTGS2
SCHEMBL8780034 0.70 PTGS2 (0.34) PTGS2
SCHEMBL8662434 0.70 EPAS1 (0.35) PSDPTGS2KCNQ3KCNQ2
SCHEMBL7782862 0.68 ALDH1A1 (0.40) PSDPTGS2CYP1A2KCNQ3KCNQ2
SCHEMBL9015062 0.68 KDM4E (0.48) PSDARF6KCNQ3KCNQ2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5739155-A Haloalkylthio,-sulfinyl and -sulfonyl arylpyrrole insecticidal and acaricidal agents AMERICAN CYANAMID CO. (US) 1998-04-14 US disclosed
EP-0549866-B1 Haloalkylthio, -sulfinyl and -sulfonyl arylpyrrole insecticidal, acaricidal and fungicidal agents AMERICAN CYANAMID CO (US) 1997-08-13 EP disclosed
US-5484807-A Haloalkylthio, -sulfinyl and -sulfonyl arylpyrrole insecticidal and acaricidal agents BASF AKTIENGESELLSCHAFT 1996-01-16 US disclosed
US-5468877-A FOR PROTECTING CROPS AMERICAN CYANAMID COMPANY (US) 1995-11-21 US disclosed
US-5306827-A Haloalkylthio, -sulfinyl and -sulfonyl arylpyrrole insecticidal and acaricidal agents AMERICAN CYANAMID COMPANY (US) 1994-04-26 US disclosed
EP-0549866-A1 Haloalkylthio, -sulfinyl and -sulfonyl arylpyrrole insecticidal, acaricidal and fungicidal agents AMERICAN CYANAMID COMPANY (US) 1993-07-07 EP disclosed