SCHEMBL2678725

SCHEMBL2678725

Nc1ccccc1C(=O)Nc1n[nH]c2c1CN(S(=O)(=O)c1cccnc1)CC2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 2/20 0.50
IGF1R P08069 2/20 0.47
CHRNB2 P17787 2/20 0.42
CHRNA4 P43681 2/20 0.42
CHRNB4 P30926 2/20 0.42
CHRNA3 P32297 2/20 0.42
CDK2 P24941 2/20 0.41
CCNE2 O96020 1/20 0.41
CCNE1 P24864 1/20 0.41
GSK3B P49841 1/20 0.41
F12 P00748 2/20 0.40
F2 P00734 1/20 0.40
KDM4E B2RXH2 1/20 0.39
POLB P06746 3/20 0.37
NAMPT P43490 1/20 0.37
HPGD P15428 1/20 0.37
AURKA O14965 1/20 0.37
CCNA2 P20248 1/20 0.37
CCNA1 P78396 1/20 0.37
KMT2A Q03164 2/20 0.36

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
SCHEMBL2678720 0.91 MET (0.50) METIGF1RCHRNB2CHRNA4CHRNB4
SCHEMBL2678969 0.87 MET (0.47) METIGF1RCHRNB2CHRNA4CHRNB4
SCHEMBL2678316 0.87 MET (0.47) METIGF1RCHRNB2CHRNA4CHRNB4
SCHEMBL2678542 0.86 IGF1R (0.48) METIGF1RCHRNB2CHRNA4CHRNB4
SCHEMBL1886628 0.86 IGF1R (0.63) METIGF1RCDK2AURKACCNA2
SCHEMBL2678663 0.85 IGF1R (0.51) METIGF1RCHRNB2CHRNA4F12
SCHEMBL2456510 0.84 IGF1R (0.60) METIGF1RCHRNB2CHRNA4CHRNB4
SCHEMBL2678537 0.83 IGF1R (0.47) METIGF1RCHRNB2CHRNA4CHRNB4
SCHEMBL4285751 0.83 AURKA (0.47) IGF1RCDK2AURKACCNA2CCNA1
SCHEMBL2676623 0.82 CDK2 (0.44) METCHRNB2CHRNA4CHRNB4CHRNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8173659-B2 Substituted pyrazolo[4,3-C]pyridine derivatives active as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2012-05-08 US disclosed
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