SCHEMBL26325865

SCHEMBL26325865

CN[C@H]1CCC[C@@H]1Nc1ncc(C(F)(F)F)c(-c2c[nH]c3c(Br)c(NC(=O)OC)ccc23)n1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CCNT1 O60563 18/20 0.48
▸ CCNK O75909 18/20 0.48
▸ CDK9 P50750 18/20 0.48
▸ CDK12 Q9NYV4 18/20 0.48
▸ CCNE1 P24864 17/20 0.48
▸ CDK2 P24941 17/20 0.48
▸ CDK7 P50613 8/20 0.47
▸ CCNH P51946 8/20 0.47
▸ MNAT1 P51948 5/20 0.47

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
SCHEMBL26325245 0.92 CCNT1 (0.46) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL26325091 0.92 CCNT1 (0.46) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL26323313 0.92 CCNT1 (0.46) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL26325090 0.92 CCNT1 (0.46) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL26325827 0.92 CCNK (0.45) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL25596528 0.90 CCNT1 (0.44) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL25596591 0.89 CCNT1 (0.43) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL25591446 0.89 CCNT1 (0.54) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL25595165 0.87 CCNK (0.51) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL25595093 0.87 CCNK (0.43) CCNT1CCNKCDK9CDK12CCNE1

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-20230295130-A1 COMPOUND USEFUL AS CDK7 KINASE INHIBITOR AND USE THEREOF TYK MEDICINES, INC. (CN) 2023-09-21 — — 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-20230295130-A1 COMPOUND USEFUL AS CDK7 KINASE INHIBITOR AND USE THEREOF CDK7, CDK6, CDK9 CCNT1 42/4885CCNK 15/4885CDK9 3/4885

“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.

Send feedback