SCHEMBL8556060

SCHEMBL8556060

CCc1nn(-c2ccccc2)c(NC(=O)NS(=O)(=O)c2ccccc2C)c1C#N

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.47
NTRK1 P04629 1/20 0.43
CA1 P00915 5/20 0.42
CA2 P00918 5/20 0.42
CA9 Q16790 5/20 0.42
CA12 O43570 3/20 0.42
FPR1 P21462 4/20 0.42
FBP1 P09467 1/20 0.41
KDM4E B2RXH2 3/20 0.38
ALKBH2 Q6NS38 1/20 0.35
ALKBH3 Q96Q83 1/20 0.35
TBXA2R P21731 2/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPK13 O15264 1/20 0.35
MAPK12 P53778 1/20 0.35
MAPK11 Q15759 1/20 0.35
MAPK14 Q16539 1/20 0.35

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
SCHEMBL8553171 0.91 NTRK1 (0.41) GAANTRK1CA1CA2CA9
SCHEMBL8557247 0.88 NTRK1 (0.51) NTRK1CA1CA2CA9CA12
SCHEMBL8556018 0.86 LMNA (0.48) GAANTRK1FPR1KDM4EALDH1A1
SCHEMBL8554704 0.85 CA1 (0.43) NTRK1CA1CA2CA9CA12
SCHEMBL8554369 0.84 GAA (0.46) GAANTRK1CA1CA2CA9
SCHEMBL8555845 0.78 LMNA (0.47) GAANTRK1FPR1KDM4EALDH1A1
SCHEMBL8555582 0.78 LMNA (0.47) GAANTRK1FPR1KDM4EALDH1A1
SCHEMBL8554179 0.78 PTGS1 (0.54) CA1CA2CA9CA12FPR1
SCHEMBL8552811 0.78 FPR1 (0.45) GAANTRK1FPR1KDM4EALDH1A1
SCHEMBL8552919 0.77 FPR1 (0.44) GAANTRK1FPR1KDM4E

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