SCHEMBL23733456

SCHEMBL23733456

CCc1ccc2c(n1)CCN(C(=O)CN1CCC(O)CC1)C2

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.43
CDK4 P11802 4/20 0.39
CDK2 P24941 4/20 0.39
CDK6 Q00534 4/20 0.39
MEN1 O00255 2/20 0.39
KDR P35968 7/20 0.38
ENPP2 Q13822 1/20 0.38
USP2 O75604 2/20 0.38
TERT O14746 2/20 0.38
LMNA P02545 1/20 0.38
ALDH1A1 P00352 1/20 0.37
CDK1 P06493 1/20 0.36
CCNB1 P14635 1/20 0.36
CCNE1 P24864 1/20 0.36
CDK7 P50613 1/20 0.36
CDK9 P50750 1/20 0.36
PARP1 P09874 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
SCHEMBL23733458 0.94 KDM4E (0.40) KDM4ECDK4CDK2CDK6MEN1
SCHEMBL23733460 0.94 KDM4E (0.40) KDM4ECDK4CDK2CDK6MEN1
SCHEMBL23733455 0.90 ALDH1A1 (0.38) KDM4ECDK4CDK2CDK6MEN1
SCHEMBL21414440 0.89 KDR (0.42) KDM4ECDK4CDK2CDK6KDR
SCHEMBL23733485 0.87 KDR (0.48) KDM4ECDK4CDK2CDK6MEN1
SCHEMBL23733480 0.87 KDM4E (0.40) KDM4ECDK4CDK2CDK6MEN1
SCHEMBL23733481 0.85 KDR (0.47) KDM4ECDK4CDK2CDK6KDR
SCHEMBL21414488 0.85 KDR (0.36) KDM4ECDK4CDK2CDK6MEN1
SCHEMBL23733486 0.84 KDR (0.42) KDM4ECDK4CDK2CDK6KDR
SCHEMBL21414420 0.84 CDK4 (0.38) KDM4ECDK4CDK2CDK6MEN1

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-11084814-B2 Pyrido[3, 4-d]pyrimidine derivative and pharmaceutically acceptable salt thereof TEIJIN PHARMA LIMITED (JP) 2021-08-10 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-11084814-B2 Pyrido[3, 4-d]pyrimidine derivative and pharmaceutically acceptable salt thereof CDK4, CDK6, CDK16 KDM4E 451/4885CDK4 1/4885CDK2 5/4885

“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.