SCHEMBL25979404

SCHEMBL25979404

CCNc1nc2c(ncn2C(C)C)c(=O)[nH]1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 7/20 0.41
CDK2 P24941 6/20 0.41
CCNB1 P14635 3/20 0.41
CCNE1 P24864 2/20 0.41
CDK9 P50750 2/20 0.41
KDM4E B2RXH2 2/20 0.41
NPC1 O15118 2/20 0.41
MAPT P10636 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
CDK5 Q00535 2/20 0.40
CCNB2 O95067 1/20 0.40
CCNB3 Q8WWL7 1/20 0.40
MAPK1 P28482 2/20 0.39
PRKACA P17612 1/20 0.39
CCNA2 P20248 1/20 0.39
PRKACG P22612 1/20 0.39
PRKACB P22694 1/20 0.39
MAPK3 P27361 1/20 0.39
CCNA1 P78396 1/20 0.39
KDM4C Q9H3R0 1/20 0.39

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
SCHEMBL21011193 0.85 KDM4E (0.44) CDK1CDK2CCNB1CCNE1CDK9
SCHEMBL17282460 0.85 CDK2 (0.44) CDK1CDK2CCNB1CCNE1KDM4E
SCHEMBL25469093 0.83 KDM4E (0.43) CDK1CDK2CCNB1CCNE1CDK9
SCHEMBL21011259 0.83 TDP1 (0.61) CDK1CDK2CCNB1CCNE1CDK9
SCHEMBL25468187 0.81 CDK2 (0.41) CDK1CDK2CCNB1CCNE1KDM4E
SCHEMBL24767728 0.80 MEN1 (0.55) CDK1CDK2CCNB1CCNE1KDM4E
SCHEMBL754057 0.80 CDK2 (0.47) CDK1CDK2CCNB1CCNE1KDM4E
SCHEMBL15763710 0.79 CDK5 (0.48) CDK1CDK2CCNB1CCNE1KDM4E
SCHEMBL22326763 0.79 PDE2A (0.48) CDK1CDK2CCNB1CCNE1CDK9
SCHEMBL21168954 0.79 CDK5 (0.52) KDM4ECDK5CDK5R1

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-11725024-B2 Antibody drug conjugates TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-08-15 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-11725024-B2 Antibody drug conjugates STING1, CGAS, TBK1 CDK1 4505/4885CDK2 4781/4885CCNB1 4775/4885

“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.