SCHEMBL31679822

SCHEMBL31679822

O=c1[nH]c2cc(OCC(F)(F)F)c(S(=O)(=O)Nc3ccc(OC(F)(F)F)cc3)cc2[nH]c1=O

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ POLB P06746 2/20 0.45
▸ ATM Q13315 1/20 0.45
▸ TP53 P04637 3/20 0.43
▸ THRB P10828 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ FFAR4 Q5NUL3 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ IDH1 O75874 2/20 0.41
▸ PKM P14618 1/20 0.40
▸ KIF11 P52732 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ SLC22A12 Q96S37 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
SCHEMBL31679843 0.89 POLB (0.55) MAPTMEN1KMT2APOLBATM
SCHEMBL24875965 0.89 MAPT (0.53) MAPTMEN1KMT2APOLBATM
SCHEMBL31679873 0.89 MAPT (0.53) MAPTMEN1KMT2APOLBATM
SCHEMBL31680001 0.86 THRB (0.53) MAPTMEN1KMT2APOLBATM
SCHEMBL24875967 0.86 THRB (0.53) MAPTMEN1KMT2APOLBATM
SCHEMBL24875961 0.83 MAPT (0.52) MAPTMEN1KMT2APOLBATM
SCHEMBL30210960 0.83 MAPT (0.52) MAPTMEN1KMT2APOLBATM
SCHEMBL31679994 0.83 MAPT (0.47) MAPTMEN1KMT2APOLBATM
SCHEMBL24876376 0.82 MAPT (0.53) MAPTMEN1KMT2APOLBATM
SCHEMBL31680017 0.82 MAPT (0.53) MAPTMEN1KMT2APOLBATM

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
EP-4367103-B1 INHIBITORS OF ALPHA-HEMOLYSIN OF STAPHYLOCOCCUS AUREUS HELMHOLTZ ZENTRUM INFEKTIONSFORSCHUNG GMBH (DE) 2025-09-03 — — EP disclosed
Send feedback