SCHEMBL8662971

SCHEMBL8662971

CCOC(=O)c1cc(SC(F)(F)C(F)F)c(-c2ccc(Cl)cc2)[nH]1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALPL P05186 1/20 0.46
ALOX15 P16050 1/20 0.45
ALOX5 P09917 2/20 0.44
TP53 P04637 1/20 0.44
MDM2 Q00987 1/20 0.44
GCGR P47871 1/20 0.43
PTGES O14684 1/20 0.42
MAPT P10636 4/20 0.39
KMT2A Q03164 4/20 0.39
MEN1 O00255 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
POLB P06746 1/20 0.39
XBP1 P17861 1/20 0.39
LMNA P02545 3/20 0.39
SIRT2 Q8IXJ6 1/20 0.39
SIRT1 Q96EB6 1/20 0.39
SIRT3 Q9NTG7 1/20 0.39
TARBP2 Q15633 1/20 0.38
ALDH1A1 P00352 4/20 0.38
KDM4E B2RXH2 3/20 0.38

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
SCHEMBL8665003 0.84 ALPL (0.49) ALPLALOX15ALOX5TP53MDM2
SCHEMBL8665554 0.78 ALPL (0.45) ALPLALOX15ALOX5TP53MDM2
SCHEMBL8663754 0.78 ALPL (0.52) ALPLALOX15ALOX5TP53MDM2
SCHEMBL8666751 0.77 ALPL (0.44) ALPLALOX15ALOX5TP53MDM2
SCHEMBL8663653 0.76 MAPT (0.46) ALPLALOX5MAPTSMN1; SMN2LMNA
SCHEMBL2542872 0.71 ALOX15 (0.53) ALPLALOX15ALOX5TP53MDM2
SCHEMBL8662138 0.70 NOTUM (0.43) ALPLKMT2AMEN1LMNAKDM4E
SCHEMBL1004515 0.68 ALPL (0.50) ALPLALOX15ALOX5TP53MDM2
SCHEMBL3500194 0.66 MMP13 (0.75) ALPLALOX15ALOX5MAPTKMT2A
SCHEMBL3498936 0.66 ALOX15 (0.80) ALPLALOX15ALOX5MAPTKMT2A

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 7 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
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