SCHEMBL6492879

SCHEMBL6492879

CSc1nc(Cl)nc2c1ncn2C

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 5/20 0.60
YTHDC1 Q96MU7 2/20 0.57
CCNE1 P24864 2/20 0.42
CDK2 P24941 2/20 0.42
CCNE2 O96020 1/20 0.42
CYP1A2 P05177 1/20 0.38
TSHR P16473 1/20 0.38
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
CCNB1 P14635 1/20 0.36
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 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
SCHEMBL12359911 0.81 KDM4E (0.41) CDK1YTHDC1CCNE1CDK2CYP1A2
SCHEMBL14566583 0.79 CDK1 (0.53) CDK1YTHDC1CCNE1CDK2CYP1A2
SCHEMBL21128173 0.79 CDK1 (0.40) CDK1YTHDC1CCNE1CDK2CYP1A2
SCHEMBL183291 0.79 CDK1 (0.51) CDK1YTHDC1CCNE1CDK2CCNE2
SCHEMBL183035 0.78 CDK1 (0.68) CDK1YTHDC1CCNE1CDK2CCNE2
SCHEMBL29426225 0.78 CDK1 (0.68) CDK1YTHDC1CCNE1CDK2CCNE2
SCHEMBL26351761 0.77 CDK1 (0.38) CDK1YTHDC1CCNE1CDK2CYP1A2
SCHEMBL12359811 0.77 PDE4A (0.43) CDK1YTHDC1CCNE1CDK2CYP1A2
SCHEMBL12375380 0.77 CYP1A2 (0.42) CDK1YTHDC1CCNE1CDK2CYP1A2
SCHEMBL25876344 0.77 CDK1 (0.66) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050288503-A1 Novel compounds ADAMS JERRY L 2005-12-29 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-20050288503-A1 Novel compounds CREBBP, NCBP1, MAPKAPK2 CDK1 282/4885YTHDC1 4038/4885CCNE1 2435/4885

“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.