SCHEMBL17048896

SCHEMBL17048896

O=[N+]([O-])C(CO)c1c(Cl)cncc1Cl

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
USP7 Q93009 3/20 0.33
USP47 Q96K76 1/20 0.31
GRK2 P25098 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
MAPK1 P28482 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL17048826 0.80 HSP90AA1 (0.38) USP7ALDH1A1LMNAMAPK1HTT
SCHEMBL17048875 0.79 GPR35 (0.36) ALDH1A1HTT
SCHEMBL17048849 0.79 ALDH1A1 (0.31) ALDH1A1
SCHEMBL17048823 0.75 HSD17B10 (0.32) ALDH1A1MAPK1HTT
SCHEMBL17048987 0.75 MEN1 (0.38) ALDH1A1LMNAHTT
SCHEMBL17048815 0.70 TDP1 (0.33)
SCHEMBL4355397 0.65 LMNA (0.40) USP7USP47ALDH1A1LMNAMAPK1
SCHEMBL4355400 0.65 LMNA (0.40) USP7USP47ALDH1A1LMNAMAPK1
SCHEMBL22749806 0.64 GSR (0.31) ALDH1A1
SCHEMBL4851936 0.64 ALDH1A1 (0.47) ALDH1A1LMNAMAPK1

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-3110810-A1 PYRAZOLE AMIDE DERIVATIVE Teijin Pharma Limited (JP) 2017-01-04 EP disclosed
WO-2015129926-A1 PYRAZOLE AMIDE DERIVATIVE TEIJIN PHARMA LIMITED (JP) 2015-09-03 WO disclosed