SCHEMBL6501882

SCHEMBL6501882

COCCNC(=O)c1ccc2c(-c3ccnc(NC4CC4)n3)c(-c3ccc(OC)cc3)nn2c1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 11/20 0.43
MAPK9 P45984 10/20 0.43
ABCB1 P08183 1/20 0.41
PIKFYVE Q9Y2I7 1/20 0.40
GSK3B P49841 3/20 0.40
CDK4 P11802 1/20 0.39
MAPK14 Q16539 1/20 0.38
HDAC8 Q9BY41 2/20 0.37

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
SCHEMBL6498415 0.86 MAPK8 (0.46) MAPK8MAPK9PIKFYVEGSK3BCDK4
SCHEMBL6490443 0.81 CSNK1D (0.48) MAPK8MAPK9GSK3BCDK4MAPK14
SCHEMBL6488212 0.79 GSK3B (0.50) GSK3BCDK4MAPK14
SCHEMBL6487352 0.78 GSK3B (0.42) MAPK8MAPK9GSK3BCDK4
SCHEMBL6484935 0.77 CSNK1D (0.49) MAPK8MAPK9PIKFYVEGSK3BCDK4
SCHEMBL14593078 0.76 MAPK14 (0.53) MAPK8MAPK9PIKFYVEGSK3BCDK4
SCHEMBL6106431 0.76 GSK3B (0.46) MAPK8MAPK9GSK3BCDK4MAPK14
SCHEMBL6484913 0.76 MAPK8 (0.53) MAPK8MAPK9PIKFYVEGSK3BCDK4
SCHEMBL5725033 0.74 MAPK8 (0.47) MAPK8MAPK9CDK4MAPK14
SCHEMBL6108305 0.73 GSK3B (0.44) MAPK8MAPK9GSK3BCDK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050107400-A1 Use of pyrazolopyridines as therapeutic compounds SMITHKLINE BEECHAM CORPORATION 2005-05-19 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 (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-20050107400-A1 Use of pyrazolopyridines as therapeutic compounds QDPR, DPYD, ENTPD5 MAPK8 1906/4885MAPK9 2403/4885ABCB1 501/4885

“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.