SCHEMBL8666764

SCHEMBL8666764

Cn1c(Br)c(Br)c(S(=O)(=O)C(F)(F)F)c1-c1ccc(Cl)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 10/20 0.41
EPAS1 Q99814 3/20 0.36
PTGS1 P23219 6/20 0.34
HTT P42858 2/20 0.33
NPC1 O15118 1/20 0.33
S1PR2 O95136 1/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
GLP1R P43220 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ATM Q13315 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
CNR1 P21554 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
KCNH2 Q12809 1/20 0.32

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
SCHEMBL8666760 0.83 EPAS1 (0.33) PTGS2EPAS1PTGS1LMNA
SCHEMBL8663775 0.81 EPAS1 (0.32) PTGS2EPAS1PTGS1MEN1KMT2A
SCHEMBL8665381 0.78 EPAS1 (0.35) PTGS2EPAS1PTGS1MEN1KMT2A
SCHEMBL8664049 0.76 MEN1 (0.38) PTGS2EPAS1PTGS1SMN1; SMN2MEN1
SCHEMBL8664683 0.74 ALDH1A1 (0.32) LMNAMEN1KMT2A
SCHEMBL8664686 0.71 PTGS1 (0.30) PTGS2PTGS1MEN1KMT2A
SCHEMBL1180312 0.69 PTGS2 (0.35) PTGS2EPAS1PTGS1KCNH2
SCHEMBL8780034 0.68 PTGS2 (0.34) PTGS2EPAS1PTGS1
SCHEMBL8662434 0.67 EPAS1 (0.35) PTGS2EPAS1KCNH2
SCHEMBL10590150 0.67 PTGS2 (0.38) PTGS2HTTNPC1LMNARAB9A

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-5284863-A Haloalkylthio, -sulfinyl and -sulfonyl arylpyrrole fungicidal agents AMERICAN CYANAMID COMPANY (US) 1994-02-08 US disclosed
EP-0549866-A1 Haloalkylthio, -sulfinyl and -sulfonyl arylpyrrole insecticidal, acaricidal and fungicidal agents AMERICAN CYANAMID COMPANY (US) 1993-07-07 EP disclosed