SCHEMBL21048864

SCHEMBL21048864

CS(=O)(=O)N(c1cccc(F)c1C#N)S(C)(=O)=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.37
KDM4E B2RXH2 4/20 0.36
HPGD P15428 2/20 0.36
HSD17B10 Q99714 1/20 0.36
PER2 O15055 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HTT P42858 3/20 0.32
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32
TAS1R2 Q8TE23 1/20 0.32
RECQL P46063 1/20 0.32
EPAS1 Q99814 2/20 0.32
DRD2 P14416 1/20 0.32
HTR2A P28223 1/20 0.32
HRH1 P35367 1/20 0.32
KMT2A Q03164 3/20 0.31
POLB P06746 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31

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
SCHEMBL6017732 0.85 KMT2A (0.39) ALDH1A1KDM4EHPGDHSD17B10L3MBTL1
SCHEMBL30986042 0.77 ALDH1A1 (0.44) ALDH1A1KDM4EHPGDHSD17B10L3MBTL1
SCHEMBL2076283 0.77 ALDH1A1 (0.44) ALDH1A1KDM4EHPGDHSD17B10L3MBTL1
SCHEMBL15461576 0.74 EPAS1 (0.45) ALDH1A1KDM4EHPGDHSD17B10HTT
SCHEMBL8377733 0.72 TAS1R3 (0.34) ALDH1A1KDM4EHPGDHSD17B10L3MBTL1
SCHEMBL17258696 0.72 ALDH1A1 (0.49) ALDH1A1KDM4EHTTKMT2APOLB
SCHEMBL186269 0.71 ALDH1A1 (0.50) ALDH1A1KDM4EHPGDHSD17B10L3MBTL1
SCHEMBL4593998 0.70 TRPV4 (0.36) PER2
SCHEMBL11089868 0.70 ALDH1A1 (0.56) ALDH1A1KDM4EHPGDHSD17B10HTT
SCHEMBL6573160 0.69 TRPV4 (0.36) ALDH1A1HTTEPAS1

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-3143021-B1 PYRAZOLOPYRIDINES AND PYRAZOLOPYRIMIDINES PFIZER (US) 2019-06-12 EP disclosed