SCHEMBL2928014

SCHEMBL2928014

CSc1nccc(-c2cc3c(NC(C)=O)n[nH]c3nc2-c2ccc(F)cc2)n1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 14/20 0.46
CSNK1D P48730 2/20 0.46
JAK3 P52333 1/20 0.46
PIK3CA P42336 2/20 0.43
GSK3B P49841 4/20 0.42
MAPK13 O15264 2/20 0.42
MAPK12 P53778 2/20 0.42
MAPK11 Q15759 2/20 0.42
KCNH2 Q12809 1/20 0.42
GSK3A P49840 3/20 0.41
CDK2 P24941 2/20 0.40
CCNA2 P20248 1/20 0.39
CSNK1E P49674 1/20 0.39
CDK5 Q00535 1/20 0.39
CDK5R1 Q15078 1/20 0.39

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
SCHEMBL2932352 0.84 GSK3B (0.40) MAPK14JAK3PIK3CAGSK3BMAPK13
SCHEMBL1385324 0.84 TOP2A (0.43) MAPK14PIK3CAGSK3BMAPK13MAPK12
SCHEMBL1385209 0.83 MAPK14 (0.49) MAPK14CSNK1DJAK3MAPK13MAPK12
SCHEMBL1385351 0.83 CDK2 (0.51) MAPK14CSNK1DJAK3MAPK13MAPK12
SCHEMBL4057799 0.83 ADORA2A (0.47) PIK3CAGSK3BGSK3A
SCHEMBL27618729 0.82 PIK3CA (0.41) MAPK14CSNK1DJAK3PIK3CAGSK3B
SCHEMBL2929634 0.80 MAPK13 (0.46) MAPK14CSNK1DJAK3GSK3BMAPK13
SCHEMBL4408117 0.79 MAPK14 (0.47) MAPK14CSNK1DJAK3PIK3CAGSK3B
SCHEMBL1386407 0.76 MAPK14 (0.52) MAPK14CSNK1DJAK3MAPK13MAPK12
SCHEMBL2926468 0.75 MAPK14 (0.48) MAPK14CSNK1DJAK3MAPK13MAPK12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8536194-B2 Pyrazolopyridine derivates PALAU PHARMA, S.A. (ES) 2013-09-17 US claimed
EP-1611131-B1 PYRAZOLOPYRIDINE DERIVATES PALAU PHARMA SA (ES) 2010-09-15 EP claimed
US-20090005377-A1 Pyrazolopyridine Derivates PALAU PHARMA, S.A. (ES) 2009-01-01 US claimed
US-7468376-B2 Pyrazolopyridine derivates PALAU PHARMA, S.A. (ES) 2008-12-23 US claimed
CN-100354275-C Pyrazolopyridine derivates URIACH Y COMPAGNIA S A J (ES) 2007-12-12 CN claimed
US-20060167040-A1 Pyrazolopyridine derivates J. URIACH Y COMPANIA S.A. (ES) 2006-07-27 US claimed
CN-1753894-A Pyrazolopyridine derivates URIACH Y COMPAGNIA S A J (ES) 2006-03-29 CN claimed
US-8536194-B2 Pyrazolopyridine derivates PALAU PHARMA, S.A. (ES) 2013-09-17 US disclosed
EP-1611131-B1 PYRAZOLOPYRIDINE DERIVATES PALAU PHARMA SA (ES) 2010-09-15 EP disclosed
US-20090286983-A1 Pyrazolopyridine Derivates PALAU PHARMA, S.A. (ES) 2009-11-19 US disclosed
US-20090005377-A1 Pyrazolopyridine Derivates PALAU PHARMA, S.A. (ES) 2009-01-01 US disclosed
US-7468376-B2 Pyrazolopyridine derivates PALAU PHARMA, S.A. (ES) 2008-12-23 US disclosed
CN-100354275-C Pyrazolopyridine derivates URIACH Y COMPAGNIA S A J (ES) 2007-12-12 CN disclosed
US-20060167040-A1 Pyrazolopyridine derivates J. URIACH Y COMPANIA S.A. (ES) 2006-07-27 US disclosed
CN-1753894-A Pyrazolopyridine derivates URIACH Y COMPAGNIA S A J (ES) 2006-03-29 CN 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 (3 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-20060167040-A1 Pyrazolopyridine derivates MAPK1, MAP4K2, MAP4K3 MAPK14 34/4885CSNK1D 75/4885JAK3 558/4885
US-20090286983-A1 Pyrazolopyridine Derivates MAPK1, MAPK4, MAP4K2 MAPK14 33/4885CSNK1D 60/4885JAK3 361/4885
US-20090005377-A1 Pyrazolopyridine Derivates MAPK1, MAPK4, MAP4K2 MAPK14 33/4885CSNK1D 60/4885JAK3 361/4885

“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.