SCHEMBL25591869

SCHEMBL25591869

COC(=O)Nc1ccc2c(-c3nc(N[C@H]4CCCNC4)ncc3Cl)c[nH]c2c1Br

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CCNT1 O60563 19/20 0.65
▸ CCNK O75909 19/20 0.65
▸ CDK9 P50750 19/20 0.65
▸ CDK12 Q9NYV4 19/20 0.65
▸ CCNE1 P24864 18/20 0.65
▸ CDK2 P24941 18/20 0.65
▸ CDK7 P50613 9/20 0.64
▸ CCNH P51946 8/20 0.64
▸ MNAT1 P51948 7/20 0.64
▸ CRBN Q96SW2 1/20 0.57

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
SCHEMBL25596998 0.92 CCNK (0.59) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL25597001 0.92 CCNK (0.59) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL25597013 0.92 CCNK (0.58) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL25597014 0.92 CCNK (0.58) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL25597018 0.91 CCNK (0.64) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL25597020 0.91 CCNK (0.64) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL25597029 0.90 CDK7 (0.59) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL25597033 0.90 CDK7 (0.59) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL25594066 0.89 CCNT1 (0.67) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL25594109 0.89 CCNT1 (0.67) 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 3 patents. 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
US-20230295130-A1 COMPOUND USEFUL AS CDK7 KINASE INHIBITOR AND USE THEREOF TYK MEDICINES, INC. (CN) 2023-09-21 — — US disclosed
EP-4186895-A1 COMPOUND USEFUL AS CDK7 KINASE INHIBITOR AND USE THEREOF TYK Medicines Inc. (CN) 2023-05-31 — — EP 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.

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