SCHEMBL12240647

SCHEMBL12240647

CCOC(=O)c1nn(C)c2c1CN(C(C)=O)c1ccccc1-2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCNA2 P20248 2/20 0.47
▸ CDK2 P24941 2/20 0.47
▸ CCNA1 P78396 2/20 0.47
▸ CDK4 P11802 1/20 0.47
▸ CCND3 P30281 1/20 0.47
▸ CDK6 Q00534 1/20 0.47
▸ TP53 P04637 3/20 0.46
▸ POLB P06746 1/20 0.46
▸ GABRG2 P18507 6/20 0.46
▸ GABRB3 P28472 6/20 0.46
▸ GABRA5 P31644 6/20 0.46
▸ GABRA2 P47869 2/20 0.46
▸ GABRA1 P14867 1/20 0.46
▸ GABRA3 P34903 1/20 0.46
▸ ELANE P08246 1/20 0.44
▸ NOTUM Q6P988 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42

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
SCHEMBL12240648 0.83 NOTUM (0.49) CCNA2CDK2CCNA1TP53POLB
SCHEMBL12240664 0.80 CCNA2 (0.59) CCNA2CDK2CCNA1CDK4CCND3
SCHEMBL2704914 0.79 KCNN4 (0.47) CCNA2CDK2CCNA1CDK4CCND3
SCHEMBL2173426 0.76 TP53 (0.73) CCNA2CDK2CCNA1CDK4CCND3
SCHEMBL6900 0.76 THRB (0.66) TP53
SCHEMBL7347 0.75 TP53 (0.66) TP53
SCHEMBL14502629 0.72 MEN1 (0.50) CCNA2CDK2CCNA1TP53ELANE
SCHEMBL2173213 0.72 THRB (0.50) TP53POLBALDH1A1HPGD
SCHEMBL6793613 0.70 CCNA2 (0.52) CCNA2CDK2CCNA1CDK4CCND3
SCHEMBL7226 0.70 THRB (0.46) CCNA2CDK2CCNA1CDK4CCND3

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-20110263588-A1 TRICYCLIC COMPOUNDS AS GLUTAMATE RECEPTOR MODULATORS GLAXO GROUP LIMITED (GB) 2011-10-27 — — 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-20110263588-A1 TRICYCLIC COMPOUNDS AS GLUTAMATE RECEPTOR MODULATORS GRM5, GRM1, GRM3 CCNA2 4399/4885CDK2 1514/4885CCNA1 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.

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