SCHEMBL14723303

SCHEMBL14723303

CC1(Nc2cc(C3CC3)[nH]n2)C=CNC(Cl)=N1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCNA2 P20248 13/20 0.41
CDK2 P24941 13/20 0.41
CCNA1 P78396 13/20 0.41
IGF1R P08069 5/20 0.39
PIK3C3 Q8NEB9 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
SCHEMBL14723304 0.73 CCNA2 (0.41) CCNA2CDK2CCNA1IGF1RPIK3C3
SCHEMBL2959316 0.67 CCNA2 (0.54) CCNA2CDK2CCNA1IGF1R
SCHEMBL13312223 0.63 CCNA2 (0.53) CCNA2CDK2CCNA1IGF1R
SCHEMBL3006826 0.62 IGF1R (0.56) CCNA2CDK2CCNA1IGF1R
SCHEMBL19360726 0.62 CCNA2 (0.52) CCNA2CDK2CCNA1IGF1R
SCHEMBL7175766 0.62 CCNA2 (0.51) CCNA2CDK2CCNA1IGF1R
SCHEMBL1164462 0.61 IGF1R (0.66) IGF1R
SCHEMBL3854177 0.61 IGF1R (0.52) CCNA2CDK2CCNA1IGF1R
SCHEMBL15704900 0.61 IGF1R (0.52) IGF1RPIK3C3
SCHEMBL2488385 0.61 PAK4 (0.60) IGF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2748159-A1 SERINE/THREONINE PAK1 INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2014-07-02 EP disclosed
US-8637537-B2 Serine/threonine kinase inhibitors GENENTECH, INC. (US) 2014-01-28 US disclosed
US-20130225620-A1 SERINE/THREONINE KINASE INHIBITORS GENENTECH, INC. (US) 2013-08-29 US disclosed
WO-2013026914-A1 SERINE/THREONINE PAK1 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2013-02-28 WO 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-20130225620-A1 SERINE/THREONINE KINASE INHIBITORS PAK1, AKT1, RB1 CCNA2 357/4885CDK2 32/4885CCNA1 113/4885

“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.