SCHEMBL25876344

SCHEMBL25876344

Cc1nc(Cl)nc2c1ncn2C

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 6/20 0.66
YTHDC1 Q96MU7 3/20 0.62
CCNE1 P24864 2/20 0.45
CDK2 P24941 2/20 0.45
CCNE2 O96020 1/20 0.45
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
CCNB1 P14635 1/20 0.38
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 1/20 0.38
KCNN2 Q9H2S1 1/20 0.36
KCNN3 Q9UGI6 1/20 0.36
CDK5 Q00535 1/20 0.34

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
SCHEMBL29426225 0.82 CDK1 (0.68) CDK1YTHDC1CCNE1CDK2CCNE2
SCHEMBL183035 0.82 CDK1 (0.68) CDK1YTHDC1CCNE1CDK2CCNE2
SCHEMBL790146 0.80 CDK1 (0.46) CDK1YTHDC1CCNE1CDK2ADORA2A
SCHEMBL129921 0.79 CDK1 (1.00) CDK1YTHDC1ADORA2AADORA1
SCHEMBL10026393 0.78 CDK1 (0.41) CDK1YTHDC1CDK2ADORA2AADORA1
SCHEMBL16481592 0.77 CDK1 (0.43) CDK1YTHDC1CCNE1CDK2CCNE2
SCHEMBL10148680 0.77 CDK1 (0.57) CDK1YTHDC1CCNE1CDK2ADORA2A
SCHEMBL19978922 0.77 CDK1 (0.60) CDK1YTHDC1CCNE1CDK2CCNE2
SCHEMBL19112004 0.77 CDK2 (0.55) CDK1CCNE1CDK2CCNE2ADORA2A
SCHEMBL13828304 0.77 CDK1 (0.60) CDK1YTHDC1CCNE1CDK2CCNE2

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
EP-3728282-B1 2'3' CYCLIC DINUCLEOTIDES WITH PHOSPHONATE BOND ACTIVATING THE STING ADAPTOR PROTEIN INST OF ORGANIC CHEMISTRY AND BIOCHEMISTRY ASCR V V I (CZ) 2023-11-22 EP disclosed
US-20230234954-A1 COMPOUND USED AS RET KINASE INHIBITOR AND APPLICATION THEREOF TYK MEDICINES, INC. (CN) 2023-07-27 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-20230234954-A1 COMPOUND USED AS RET KINASE INHIBITOR AND APPLICATION THEREOF RET, ROR1, FGFR3 CDK1 656/4885YTHDC1 4091/4885CCNE1 2236/4885

“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.