SCHEMBL17536908

SCHEMBL17536908

Cc1ccc(-c2cccc(-c3cccc(OS(=O)(=O)C(F)(F)F)c3)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALKBH3 Q96Q83 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ PTPN5 P54829 2/20 0.44
▸ FFAR4 Q5NUL3 1/20 0.43
▸ KCNH2 Q12809 3/20 0.42
▸ PTPN1 P18031 1/20 0.41
▸ DHODH Q02127 1/20 0.40
▸ PTGS2 P35354 1/20 0.40
▸ PTGES2 Q9H7Z7 1/20 0.40
▸ MAOB P27338 1/20 0.39
▸ RXRA P19793 1/20 0.39
▸ RXRB P28702 1/20 0.39
▸ ABL1 P00519 1/20 0.39
▸ ABCB1 P08183 1/20 0.39
▸ BCR P11274 1/20 0.39

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
SCHEMBL15086987 0.88 PPARG (0.46) PTPN5KCNH2PTGS2PTGES2
SCHEMBL4684800 0.87 PTPN1 (0.47) PTPN5KCNH2PTPN1
SCHEMBL13416088 0.87 CA1 (0.45) KCNH2PTPN1
SCHEMBL3670256 0.84 GSTP1 (0.46) FFAR4KCNH2PTPN1
SCHEMBL27542368 0.84 MRGPRX4 (0.46) PTPN5KCNH2PTPN1
SCHEMBL3679922 0.83 FFAR4 (0.48) FFAR4KCNH2PTPN1
SCHEMBL27520200 0.83 ALDH1A1 (0.42) PTPN5KCNH2PTPN1DHODHPTGS2
SCHEMBL27515742 0.83 KIF11 (0.52) PTPN5PTPN1DHODHPTGES2
SCHEMBL27517450 0.83 ADORA2A (0.46) CYP1A2PTPN5KCNH2PTPN1
Biphenyl SCHEMBL114434 0.82 CA2 (0.50) CYP1A2CYP2C19PTPN5PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9944846-B2 Compositions for electronic applications E I DU PONT DE NEMOURS AND COMPANY (US) 2018-04-17 — — US disclosed
US-9944846-B2 Compositions for electronic applications E I DU PONT DE NEMOURS AND COMPANY (US) 2018-04-17 — — US disclosed
US-9944846-B2 Compositions for electronic applications E I DU PONT DE NEMOURS AND COMPANY (US) 2018-04-17 — — US disclosed
US-20160060512-A1 COMPOSITIONS FOR ELECTRONIC APPLICATIONS LG CHEM, LTD. (KR) 2016-03-03 — — US disclosed
US-20160060512-A1 COMPOSITIONS FOR ELECTRONIC APPLICATIONS LG CHEM, LTD. (KR) 2016-03-03 — — US disclosed
US-20160060512-A1 COMPOSITIONS FOR ELECTRONIC APPLICATIONS LG CHEM, LTD. (KR) 2016-03-03 — — US disclosed
WO-2016033167-A1 COMPOSITIONS FOR ELECTRONIC APPLICATIONS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2016-03-03 — — WO disclosed
WO-2016033167-A1 COMPOSITIONS FOR ELECTRONIC APPLICATIONS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2016-03-03 — — WO disclosed
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