SCHEMBL2548366

SCHEMBL2548366

Cn1nc(C(=O)O)c2c1-c1ncccc1CC2

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 19/20 0.57
CCNA2 P20248 18/20 0.57
CCNA1 P78396 17/20 0.57
AURKA O14965 13/20 0.57
PLK1 P53350 9/20 0.57
CDK4 P11802 4/20 0.47
CCND3 P30281 4/20 0.47
CDK6 Q00534 4/20 0.47
PLK3 Q9H4B4 4/20 0.47
PLK2 Q9NYY3 4/20 0.47
TTK P33981 3/20 0.47
PTAFR P25105 1/20 0.43

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
SCHEMBL7911087 0.92 CDK2 (0.49) CDK2CCNA2CCNA1AURKAPLK1
SCHEMBL2548991 0.86 AURKA (0.49) CDK2CCNA2CCNA1AURKAPLK1
SCHEMBL2550010 0.85 CDK2 (0.43) CDK2CCNA2CCNA1AURKAPLK1
SCHEMBL2540871 0.83 CCNA2 (0.60) CDK2CCNA2CCNA1AURKAPLK1
SCHEMBL2187536 0.81 CDK2 (0.56) CDK2CCNA2CCNA1AURKAPLK1
SCHEMBL7909158 0.79 CCNA2 (0.37) CDK2CCNA2CCNA1AURKAPLK1
SCHEMBL10220785 0.78 CCNA2 (0.57) CDK2CCNA2CCNA1AURKAPLK1
SCHEMBL31326950 0.78 CCNA2 (0.57) CDK2CCNA2CCNA1AURKAPLK1
SCHEMBL7913880 0.78 CDK2 (0.57) CDK2CCNA2CCNA1AURKAPLK1
SCHEMBL2185709 0.78 CDK2 (0.48) CDK2CCNA2CCNA1AURKAPLK1

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
US-20110263588-A1 TRICYCLIC COMPOUNDS AS GLUTAMATE RECEPTOR MODULATORS GLAXO GROUP LIMITED (GB) 2011-10-27 US disclosed
US-20110263588-A1 TRICYCLIC COMPOUNDS AS GLUTAMATE RECEPTOR MODULATORS GLAXO GROUP LIMITED (GB) 2011-10-27 US disclosed
US-20110263588-A1 TRICYCLIC COMPOUNDS AS GLUTAMATE RECEPTOR MODULATORS GLAXO GROUP LIMITED (GB) 2011-10-27 US disclosed
WO-2010049366-A1 TRICYCLIC COMPOUNDS AS GLUTAMATE RECEPTOR MODULATORS GLAXO GROUP LIMITED (GB) 2010-05-06 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-20110263588-A1 TRICYCLIC COMPOUNDS AS GLUTAMATE RECEPTOR MODULATORS GRM5, GRM1, GRM3 CDK2 1514/4885CCNA2 4399/4885CCNA1 4676/4885

“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.