SCHEMBL30745878

SCHEMBL30745878

CS(=O)(=O)c1cc(NC(=O)c2ccc(OCCc3ccc(SC(F)(F)F)cc3)cc2)ccc1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 2/20 0.47
▸ PPARA Q07869 6/20 0.46
▸ PTPN2 P17706 1/20 0.44
▸ PTPN1 P18031 1/20 0.44
▸ PTPN7 P35236 1/20 0.44
▸ NR1H4 Q96RI1 3/20 0.43
▸ EPHX2 P34913 1/20 0.43
▸ CCR5 P51681 1/20 0.42
▸ LMNA P02545 3/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ KCNK2 O95069 3/20 0.42
▸ KCNK10 P57789 2/20 0.42
▸ PPARG P37231 1/20 0.40
▸ PPARD Q03181 1/20 0.40
▸ MAPT P10636 2/20 0.39
▸ CXCR2 P25025 1/20 0.39
▸ TP53 P04637 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
SCHEMBL29279995 1.00 TRPV1 (0.47) TRPV1PPARAPTPN2PTPN1PTPN7
SCHEMBL29279854 0.96 TRPV1 (0.47) TRPV1PPARAPTPN2PTPN1PTPN7
SCHEMBL29280132 0.91 PTPN2 (0.51) TRPV1PPARAPTPN2PTPN1PTPN7
SCHEMBL29280034 0.91 PTPN2 (0.51) TRPV1PPARAPTPN2PTPN1PTPN7
SCHEMBL29279899 0.91 TRPV1 (0.55) TRPV1PPARANR1H4EPHX2CCR5
SCHEMBL29279812 0.89 PPARA (0.56) TRPV1PPARANR1H4EPHX2LMNA
SCHEMBL30745891 0.89 PPARA (0.56) TRPV1PPARANR1H4EPHX2LMNA
SCHEMBL29280054 0.88 TRPV1 (0.50) TRPV1PPARANR1H4EPHX2CCR5
SCHEMBL29280075 0.88 TRPV1 (0.50) TRPV1PPARANR1H4EPHX2CCR5
SCHEMBL29280114 0.87 TRPV1 (0.62) TRPV1PPARANR1H4EPHX2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117682973-A Sulfonamide compound and medical application thereof 中国药科大学 2024-03-12 — — CN disclosed
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