SCHEMBL2929958

SCHEMBL2929958

Cc1n[nH]c2nc(-c3ccccc3)c(-c3ccncc3)c(-c3ccccc3)c12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT2 P31751 2/20 0.44
CHEK1 O14757 1/20 0.44
MAPK13 O15264 3/20 0.41
MAPK12 P53778 3/20 0.41
MAPK11 Q15759 3/20 0.41
MAPK14 Q16539 3/20 0.41
MKNK1 Q9BUB5 1/20 0.40
RAF1 P04049 2/20 0.39
MAPK9 P45984 2/20 0.39
ALDH1A1 P00352 1/20 0.38
ADORA1 P30542 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
NOTUM Q6P988 1/20 0.38
GRM5 P41594 1/20 0.38
ADORA2A P29274 1/20 0.38
KDM4E B2RXH2 1/20 0.36
HPGD P15428 1/20 0.36
LRRK2 Q5S007 1/20 0.36
IMPDH2 P12268 1/20 0.36
CDC7 O00311 1/20 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
SCHEMBL2931965 0.86 MAPK14 (0.47) MAPK13MAPK12MAPK11MAPK14RAF1
SCHEMBL1385646 0.81 MAPK1 (0.40) MAPK11MAPK14ADORA2ALRRK2
SCHEMBL1385467 0.79 MAPK1 (0.39) CHEK1MAPK13MAPK12MAPK11MAPK14
SCHEMBL7255602 0.75 GSK3B (0.54) AKT2CHEK1ALDH1A1SMN1; SMN2GRM5
SCHEMBL9937001 0.73 NOTUM (0.58) MAPK13MAPK12MAPK11MAPK14MKNK1
SCHEMBL12692734 0.73 GRM5 (0.41) AKT2CHEK1ALDH1A1GRM5KDM4E
SCHEMBL1386721 0.71 FGFR1 (0.45) MAPK13MAPK12MAPK11MAPK14MKNK1
SCHEMBL14519374 0.71 LRRK2 (0.60) AKT2CHEK1MKNK1LRRK2KMT2A
SCHEMBL5253523 0.71 AKT2 (0.58) AKT2CHEK1MAPK13MAPK12MAPK11
SCHEMBL6078226 0.71 AKT2 (0.58) AKT2CHEK1MAPK13MAPK12MAPK11

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 11 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
US-20060167040-A1 Pyrazolopyridine derivates J. URIACH Y COMPANIA S.A. (ES) 2006-07-27 US 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
US-20060167040-A1 Pyrazolopyridine derivates J. URIACH Y COMPANIA S.A. (ES) 2006-07-27 US 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 AKT2 230/4885CHEK1 217/4885MAPK13 36/4885
US-20090286983-A1 Pyrazolopyridine Derivates MAPK1, MAPK4, MAP4K2 AKT2 208/4885CHEK1 249/4885MAPK13 37/4885
US-20090005377-A1 Pyrazolopyridine Derivates MAPK1, MAPK4, MAP4K2 AKT2 208/4885CHEK1 249/4885MAPK13 37/4885

“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.