SCHEMBL31270302

SCHEMBL31270302

O=C(O)[C@H]1CCC[C@@H](Nc2ncc(C(F)(F)F)c(-c3c[nH]c4ccccc34)n2)C1

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CCNE1 P24864 18/20 0.69
CDK2 P24941 18/20 0.69
CCNK O75909 18/20 0.69
CDK12 Q9NYV4 18/20 0.69
CCNT1 O60563 15/20 0.69
CDK9 P50750 15/20 0.69
CDK7 P50613 13/20 0.69
CCNH P51946 13/20 0.69
MNAT1 P51948 11/20 0.69

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
SCHEMBL25598393 0.88 CCNE1 (0.65) CCNE1CDK2CCNKCDK12CCNT1
SCHEMBL17150675 0.86 CDK7 (0.71) CCNE1CDK2CCNKCDK12CCNT1
SCHEMBL17150448 0.86 CCNK (0.73) CCNE1CDK2CCNKCDK12CCNT1
SCHEMBL19024488 0.86 CCNE1 (0.65) CCNE1CDK2CCNKCDK12CCNT1
SCHEMBL17150717 0.84 CCNE1 (0.60) CCNE1CDK2CCNKCDK12CCNT1
SCHEMBL30456603 0.83 CCNK (0.69) CCNE1CDK2CCNKCDK12CCNT1
SCHEMBL17150422 0.82 CDK7 (0.68) CCNE1CDK2CCNKCDK12CCNT1
SCHEMBL20416186 0.82 CCNK (0.62) CCNE1CDK2CCNKCDK12CCNT1
SCHEMBL24839343 0.82 CCNK (1.00) CCNE1CDK2CCNKCDK12CCNT1
SCHEMBL29498427 0.82 CCNK (1.00) CCNE1CDK2CCNKCDK12CCNT1

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-20240360165-A1 INHIBITORS OF CYCLIN DEPENDENT KINASE 7 (CDK7) MEDIC LIFE SCIENCES, INC. 2024-10-31 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-20240360165-A1 INHIBITORS OF CYCLIN DEPENDENT KINASE 7 (CDK7) CDK7, CDK3, CDK9 CCNE1 51/4885CDK2 10/4885CCNK 11/4885

“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.