SCHEMBL4873401

SCHEMBL4873401

O=C(Nc1n[nH]c2c1CN(S(=O)(=O)c1cc(F)cc(F)c1)CC2)c1ccncc1[AsH2]

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 3/20 0.61
MET P08581 3/20 0.40
EP300 Q09472 5/20 0.39
CREBBP Q92793 5/20 0.39
CCNA2 P20248 2/20 0.38
CDK2 P24941 2/20 0.38
CCNA1 P78396 2/20 0.38
AURKA O14965 1/20 0.37
HMOX1 P09601 2/20 0.35
F12 P00748 3/20 0.35
BRD4 O60885 1/20 0.34
KIF18A Q8NI77 1/20 0.34
DPP4 P27487 1/20 0.34
DPP8 Q6V1X1 1/20 0.34
F2 P00734 1/20 0.34

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
SCHEMBL1888166 0.90 IGF1R (0.60) IGF1RMETEP300CREBBPCCNA2
SCHEMBL1893031 0.85 IGF1R (0.72) IGF1RMETEP300CREBBPCCNA2
SCHEMBL1889404 0.85 IGF1R (0.60) IGF1RMETEP300CREBBPCCNA2
SCHEMBL1884807 0.84 IGF1R (0.56) IGF1RMETAURKAF12
SCHEMBL1896236 0.83 IGF1R (0.55) IGF1RMETCCNA2CDK2CCNA1
SCHEMBL1894216 0.83 IGF1R (0.57) IGF1RMETEP300CREBBPCCNA2
SCHEMBL1885146 0.83 IGF1R (0.52) IGF1RMETDPP4DPP8
SCHEMBL1889115 0.83 IGF1R (0.52) IGF1RMETDPP4DPP8
SCHEMBL1885148 0.83 IGF1R (0.52) IGF1RMETDPP4DPP8
SCHEMBL1889723 0.82 IGF1R (0.52) IGF1RMETCCNA2CDK2CCNA1

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-1968976-A1 SUBSTITUTED PYRAZOLO [4,3-C] PYRIDINE DERIVATIVES ACTIVE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.r.l. (IT) 2008-09-17 EP disclosed
WO-2007068619-A1 SUBSTITUTED PYRAZOLO [4,3-C] PYRIDINE DERIVATIVES ACTIVE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2007-06-21 WO disclosed