SCHEMBL17094906

SCHEMBL17094906

CCNc1n[nH]c2cc(C=O)ccc12

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 10/20 0.50
TTK P33981 1/20 0.46
MAP2K4 P45985 3/20 0.43
MAPK1 P28482 4/20 0.40
DYRK1A Q13627 1/20 0.40
KIF11 P52732 1/20 0.40

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
SCHEMBL15651827 0.77 TTK (0.49) GSK3BTTKKIF11
SCHEMBL29957557 0.77 TTK (0.49) GSK3BTTKKIF11
SCHEMBL15652140 0.74 TTK (0.52) GSK3BTTKKIF11
SCHEMBL15652215 0.73 TTK (0.46) GSK3BTTKMAPK1KIF11
SCHEMBL13727221 0.73 PDPK1 (0.55) TTKKIF11
SCHEMBL13996487 0.73 UTS2R (0.50) TTK
SCHEMBL3538242 0.73 TTK (0.54) TTKKIF11
SCHEMBL17094915 0.71 TTK (0.44) GSK3BTTKDYRK1AKIF11
SCHEMBL29952255 0.71 TTK (0.52) GSK3BTTKMAP2K4KIF11
SCHEMBL578196 0.71 TTK (0.52) GSK3BTTKKIF11

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-9637491-B2 Pyrazolo[4,3-D]pyrimidines as kinase inhibitors ORIGENIS GMBH (DE) 2017-05-02 US disclosed
US-20150266882-A1 PYRAZOLO[4,3-D]PYRIMIDINES AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2015-09-24 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-20150266882-A1 PYRAZOLO[4,3-D]PYRIMIDINES AS KINASE INHIBITORS LRRK2, MYLK2, MYLK GSK3B 174/4885TTK 101/4885MAP2K4 246/4885

“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.