SCHEMBL10241903

SCHEMBL10241903

Cc1cccc(Nc2nc(Nc3ccc(N)cc3)ncc2C(N)=O)c1

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SYK P43405 18/20 0.70
KCNH2 Q12809 4/20 0.70
AURKB Q96GD4 3/20 0.70
ZAP70 P43403 1/20 0.70
MAPK8 P45983 1/20 0.65
MAPK9 P45984 1/20 0.65
MAPK3 P27361 2/20 0.63
MAPK1 P28482 2/20 0.63
GP6 Q9HCN6 1/20 0.63
STAT6 P42226 1/20 0.63

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
SCHEMBL14659023 0.93 SYK (0.72) SYKKCNH2AURKBZAP70MAPK8
SCHEMBL29761550 0.93 SYK (0.72) SYKKCNH2AURKBZAP70MAPK8
SCHEMBL763269 0.92 SYK (0.69) SYKKCNH2AURKBZAP70MAPK8
SCHEMBL763608 0.92 STAT6 (0.73) SYKKCNH2AURKBZAP70MAPK8
SCHEMBL15161258 0.92 SYK (0.69) SYKKCNH2AURKBZAP70MAPK8
SCHEMBL764204 0.92 SYK (0.71) SYKKCNH2AURKBZAP70MAPK3
SCHEMBL763221 0.91 SYK (0.67) SYKKCNH2AURKBZAP70MAPK8
SCHEMBL15161205 0.90 SYK (0.66) SYKKCNH2AURKBZAP70MAPK8
SCHEMBL2493850 0.90 SYK (0.72) SYKKCNH2AURKBZAP70STAT6
SCHEMBL763232 0.90 SYK (0.69) SYKKCNH2AURKBZAP70MAPK8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8138339-B2 Inhibitors of protein kinases PORTOLA PHARMACEUTICALS, INC. (US) 2012-03-20 US disclosed
US-20090318407-A1 Inhibitors of protein kinases PORTOLA PHARMACEUTICALS, INC. (US) 2009-12-24 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-20090318407-A1 Inhibitors of protein kinases SYK, BTK, JAK1 SYK 1/4885KCNH2 3335/4885AURKB 511/4885

“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.