SCHEMBL21728893

SCHEMBL21728893

Cc1ccc(S(=O)(=O)C(F)(F)F)cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
EPAS1 Q99814 6/20 0.52
ALDH1A1 P00352 1/20 0.50
POLB P06746 1/20 0.46
PTGS2 P35354 3/20 0.45
ESPL1 Q14674 1/20 0.45
PTGS1 P23219 2/20 0.44
LMNA P02545 3/20 0.43
HTT P42858 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
FLT1 P17948 1/20 0.42
FLT4 P35916 1/20 0.42
KDR P35968 1/20 0.42
MAPK1 P28482 1/20 0.42

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
SCHEMBL14453589 0.85 MEN1 (0.56) MEN1KMT2AEPAS1ALDH1A1POLB
SCHEMBL21983964 0.82 LMNA (0.55) MEN1KMT2AEPAS1ALDH1A1POLB
SCHEMBL16555813 0.79 EPAS1 (0.56) MEN1KMT2AEPAS1ALDH1A1PTGS2
SCHEMBL29217918 0.79 ALDH1A1 (0.52) MEN1KMT2AEPAS1ALDH1A1POLB
SCHEMBL29957896 0.79 POLB (0.48) MEN1KMT2AEPAS1ALDH1A1POLB
SCHEMBL12537977 0.79 POLB (0.48) MEN1KMT2AEPAS1ALDH1A1POLB
SCHEMBL5936707 0.78 LMNA (0.50) ALDH1A1POLBPTGS2PTGS1LMNA
SCHEMBL24456745 0.78 EPAS1 (0.59) MEN1KMT2AEPAS1ALDH1A1POLB
SCHEMBL1881348 0.78 ALDH1A1 (0.70) MEN1KMT2AEPAS1ALDH1A1POLB
SCHEMBL13556573 0.78 ALDH1A1 (0.70) MEN1KMT2AEPAS1ALDH1A1POLB

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-2773616-B1 PESTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2020-02-19 EP disclosed