SCHEMBL2679281

SCHEMBL2679281

CN(C)c1ccc(C(=O)Nc2n[nH]c3c2CN(S(=O)(=O)c2cccnc2)CC3(C)C)c(N)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 5/20 0.41
CCNA2 P20248 3/20 0.41
CCNA1 P78396 3/20 0.41
HDAC1 Q13547 3/20 0.39
NTRK1 P04629 4/20 0.39
CCNE2 O96020 2/20 0.38
CCNE1 P24864 2/20 0.38
GSK3B P49841 2/20 0.38
CHRNB2 P17787 1/20 0.36
CHRNA4 P43681 1/20 0.36
PRKCB P05771 2/20 0.34
PAK4 O96013 2/20 0.34
MET P08581 1/20 0.34
POLB P06746 1/20 0.34
MAPT P10636 1/20 0.34
RECQL P46063 1/20 0.34
CTDSP1 Q9GZU7 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
GAA P10253 1/20 0.34
TSHR P16473 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
SCHEMBL2679278 0.92 CDK2 (0.42) CDK2CCNA2CCNA1HDAC1NTRK1
SCHEMBL2676623 0.88 CDK2 (0.44) CDK2CCNA2CCNA1NTRK1CCNE2
SCHEMBL2679294 0.88 CHRNB4 (0.43) CDK2CCNA2CCNA1NTRK1CCNE2
SCHEMBL1891400 0.87 NTRK1 (0.48) CDK2CCNA2CCNA1NTRK1CCNE1
SCHEMBL1887368 0.87 IGF1R (0.46) CDK2CCNA2CCNA1HDAC1NTRK1
SCHEMBL2677972 0.85 NTRK1 (0.42) CDK2CCNA2CCNA1HDAC1NTRK1
SCHEMBL2678316 0.85 MET (0.47) CDK2HDAC1CCNE2CCNE1GSK3B
SCHEMBL2676622 0.84 CDK2 (0.44) CDK2CCNA2CCNA1NTRK1CCNE2
SCHEMBL2679291 0.81 CHRNB4 (0.42) CDK2CCNA2CCNA1NTRK1CCNE2
SCHEMBL2678206 0.81 CCNA2 (0.42) CDK2CCNA2CCNA1NTRK1CHRNB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2120932-A1 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER Nerviano Medical Sciences S.r.l. (IT) 2009-11-25 EP claimed
US-20090023745-A1 Substituted Pyrazolo[4,3-c]Pyridine Derivatives Active as Kinase Inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2009-01-22 US claimed
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 claimed
WO-2008074749-A1 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2008-06-26 WO claimed
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 claimed
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
US-20090023745-A1 Substituted Pyrazolo[4,3-c]Pyridine Derivatives Active as Kinase Inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2009-01-22 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090023745-A1 Substituted Pyrazolo[4,3-c]Pyridine Derivatives Active as Kinase Inhibitors MAP3K3, MAP3K1, MAP3K19 CDK2 91/4885CCNA2 1202/4885CCNA1 817/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.