SCHEMBL4484878

SCHEMBL4484878

CC(=O)N1Cc2[nH]nc([N]C(=O)COc3ccccc3)c2C1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCNA2 P20248 8/20 0.49
CDK2 P24941 8/20 0.49
CCNA1 P78396 8/20 0.49
AURKA O14965 6/20 0.49
CREBBP Q92793 6/20 0.43
EP300 Q09472 5/20 0.43
BRD4 O60885 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPK1 P28482 1/20 0.37

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
SCHEMBL2920175 0.78 CCNA2 (0.72) CCNA2CDK2CCNA1AURKACREBBP
SCHEMBL5720857 0.72 AURKA (0.53) CCNA2CDK2CCNA1AURKACREBBP
SCHEMBL5720875 0.72 CCNA2 (0.55) CCNA2CDK2CCNA1AURKACREBBP
SCHEMBL5720828 0.71 MAPK1 (0.55) CCNA2CDK2CCNA1AURKACREBBP
SCHEMBL5720802 0.71 BRD4 (0.62) CCNA2CDK2CCNA1AURKACREBBP
SCHEMBL2920178 0.69 AURKA (0.47) CCNA2CDK2CCNA1AURKAL3MBTL1
SCHEMBL2913735 0.67 AURKA (0.81) CCNA2CDK2CCNA1AURKA
SCHEMBL17868293 0.67 MEN1 (0.55) CREBBPEP300BRD4L3MBTL1MEN1
SCHEMBL2916810 0.67 CCNA2 (0.58) CCNA2CDK2CCNA1AURKAMAPK1
SCHEMBL2916913 0.67 CCNA2 (0.72) CCNA2CDK2CCNA1AURKA

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.