SCHEMBL8551653

SCHEMBL8551653

Cc1nn(-c2ccccc2)c(NC(=O)NS(C)(=O)=O)c1C#N

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 2/20 0.53
KDM4E B2RXH2 4/20 0.44
POLB P06746 2/20 0.41
APEX1 P27695 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
FPR1 P21462 4/20 0.41
HPGD P15428 3/20 0.40
ALDH1A1 P00352 3/20 0.39
HTT P42858 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 1/20 0.39
ABCB1 P08183 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 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
SCHEMBL8557247 0.86 NTRK1 (0.51) NTRK1KDM4EPOLBAPEX1TDP1
SCHEMBL8550650 0.86 FPR1 (0.53) NTRK1KDM4EPOLBFPR1ALDH1A1
SCHEMBL8555862 0.84 NTRK1 (0.48) NTRK1KDM4EPOLBFPR1ALDH1A1
SCHEMBL1984012 0.84 NTRK1 (0.48) NTRK1POLBFPR1ALDH1A1HTT
SCHEMBL8552895 0.82 FPR1 (0.48) NTRK1POLBTDP1FPR1ALDH1A1
SCHEMBL8553146 0.81 NTRK1 (0.54) NTRK1KDM4EPOLBHPGDALDH1A1
SCHEMBL8554132 0.76 GAA (0.48) NTRK1KDM4EPOLBHPGDALDH1A1
SCHEMBL1244767 0.75 PTGS2 (0.49) NTRK1KDM4EPOLBTDP1FPR1
SCHEMBL8554704 0.75 CA1 (0.43) NTRK1KDM4EPOLBTDP1FPR1
SCHEMBL8553012 0.75 LMNA (0.49) KDM4EPOLBFPR1ALDH1A1LMNA

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-0885890-A1 SULFONYLUREIDOPYRAZOLE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1998-12-23 EP disclosed