SCHEMBL8553385

SCHEMBL8553385

Cc1nn(-c2ccccc2)c(N(Cc2ccccc2)C(=O)NS(=O)(=O)c2ccc(Cl)cc2)c1C#N

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
MAPT P10636 3/20 0.42
NPSR1 Q6W5P4 2/20 0.41
PTGES O14684 4/20 0.40
ALOX5 P09917 4/20 0.40
LMNA P02545 3/20 0.40
HTT P42858 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 1/20 0.40
XBP1 P17861 1/20 0.40
RAB9A P51151 1/20 0.40
PAX8 Q06710 1/20 0.40
CRHBP P24387 1/20 0.40
CRHR2 Q13324 1/20 0.40
POLB P06746 2/20 0.39
STS P08842 1/20 0.39
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TMEM97 Q5BJF2 1/20 0.37
SIGMAR1 Q99720 1/20 0.37

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
SCHEMBL8555849 0.89 ALDH1A1 (0.44) ALDH1A1MAPTNPSR1PTGESALOX5
SCHEMBL8556539 0.87 MAPT (0.42) ALDH1A1MAPTNPSR1PTGESALOX5
SCHEMBL8555334 0.86 MAPT (0.46) ALDH1A1MAPTPTGESALOX5LMNA
SCHEMBL8553095 0.85 ALDH1A1 (0.46) ALDH1A1MAPTPTGESALOX5LMNA
SCHEMBL8554394 0.83 ALDH1A1 (0.39) ALDH1A1MAPTHTTSMN1; SMN2POLB
SCHEMBL8553364 0.77 PTGES (0.49) ALDH1A1MAPTNPSR1PTGESLMNA
SCHEMBL1984012 0.77 NTRK1 (0.48) ALDH1A1MAPTPTGESALOX5LMNA
SCHEMBL8556278 0.72 NTRK1 (0.43) ALDH1A1MAPTNPSR1HTTSMN1; SMN2
SCHEMBL8554369 0.69 GAA (0.46) ALDH1A1MAPTNPSR1PTGESALOX5
SCHEMBL8550650 0.69 FPR1 (0.53) ALDH1A1LMNAHTTPOLBKMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

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