SCHEMBL26324669

SCHEMBL26324669

COC(=O)Nc1ccc2c(-c3nc(N[C@@H]4[C@@H]5CNC[C@@H]54)ncc3C(F)(F)F)c[nH]c2c1Br

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CCNK O75909 17/20 0.48
▸ CDK12 Q9NYV4 17/20 0.48
▸ CCNT1 O60563 16/20 0.48
▸ CDK9 P50750 16/20 0.48
▸ CDK7 P50613 9/20 0.48
▸ CCNH P51946 9/20 0.48
▸ MNAT1 P51948 6/20 0.48
▸ CCNE1 P24864 17/20 0.47
▸ CDK2 P24941 17/20 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
SCHEMBL25591497 0.89 CCNK (0.50) CCNKCDK12CCNT1CDK9CDK7
SCHEMBL25591494 0.88 CCNT1 (0.45) CCNKCDK12CCNT1CDK9CDK7
SCHEMBL25581446 0.88 CCNK (0.60) CCNKCDK12CCNT1CDK9CDK7
SCHEMBL25581449 0.88 CCNK (0.60) CCNKCDK12CCNT1CDK9CDK7
SCHEMBL25595180 0.88 CCNT1 (0.60) CCNKCDK12CCNT1CDK9CDK7
SCHEMBL26325167 0.88 CCNT1 (0.60) CCNKCDK12CCNT1CDK9CDK7
SCHEMBL25591583 0.88 CCNT1 (0.60) CCNKCDK12CCNT1CDK9CDK7
SCHEMBL25581375 0.88 CCNT1 (0.53) CCNKCDK12CCNT1CDK9CDK7
SCHEMBL25581444 0.87 CDK7 (0.44) CCNKCDK12CCNT1CDK9CDK7
SCHEMBL25591446 0.87 CCNT1 (0.54) CCNKCDK12CCNT1CDK9CDK7

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 CCNK 15/4885CDK12 27/4885CCNT1 42/4885

“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.

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