SCHEMBL4484875

SCHEMBL4484875

CC(=O)[N]Oc1ccccc1-c1[nH]nc2c1CN(C(C)=O)C2

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CCNA2 P20248 7/20 0.37
CDK2 P24941 7/20 0.37
CCNA1 P78396 7/20 0.37
AURKA O14965 6/20 0.37
NOTUM Q6P988 1/20 0.35
CREBBP Q92793 8/20 0.34
EP300 Q09472 6/20 0.34
BRD4 O60885 2/20 0.34
MAPK1 P28482 1/20 0.33
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
BAZ2B Q9UIF8 1/20 0.31
PDGFRB P09619 1/20 0.31
FYN P06241 1/20 0.31

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
SCHEMBL2920173 0.82 CCNA2 (0.39) CCNA2CDK2CCNA1AURKANOTUM
SCHEMBL5720799 0.76 CCNA2 (0.47) CCNA2CDK2CCNA1AURKANOTUM
SCHEMBL2915617 0.73 AURKA (0.44) CCNA2CDK2CCNA1AURKACREBBP
SCHEMBL2916804 0.72 MTOR (0.35) CCNA2CDK2CCNA1AURKAMAPK1
SCHEMBL5720830 0.71 BTK (0.47) CCNA2CDK2CCNA1AURKACREBBP
SCHEMBL2919942 0.71 CCNA2 (0.41) CCNA2CDK2CCNA1CREBBPEP300
SCHEMBL2913543 0.70 CCNA2 (0.39) CCNA2CDK2CCNA1AURKACREBBP
SCHEMBL5720882 0.69 AURKA (0.51) CCNA2CDK2CCNA1AURKACREBBP
SCHEMBL2924399 0.69 KDM4E (0.40) MAPK1MAPT
SCHEMBL2918879 0.68 MAPT (0.49) CCNA2CDK2CCNA1AURKAMAPK1

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-7541354-B2 Bicyclo-pyrazoles PFIZER ITALIA S.R.L. (IT) 2009-06-02 US disclosed
US-20030171357-A1 Bicyclo-pyrazoles active as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them NERVIANO MEDICAL SCIENCES S.R.L (IT) 2003-09-11 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-20030171357-A1 Bicyclo-pyrazoles active as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them MAP3K20, MAP3K19, MAP3K1 CCNA2 848/4885CDK2 43/4885CCNA1 793/4885

“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.