SCHEMBL25223841

SCHEMBL25223841

C=CC(=O)Nc1ccc2c(c1)nc([C@H]1CCC[C@@H](Nc3ncc(C#N)c(OC)n3)C1)n2CCOC(C)=O

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CCNK O75909 12/20 0.51
▸ CDK12 Q9NYV4 12/20 0.51
▸ CDK13 Q14004 1/20 0.39
▸ EGFR P00533 4/20 0.39
▸ CCNA2 P20248 6/20 0.39
▸ CDK2 P24941 6/20 0.39
▸ CDK7 P50613 6/20 0.39
▸ CCNH P51946 6/20 0.39
▸ MNAT1 P51948 6/20 0.39
▸ JAK3 P52333 2/20 0.38
▸ BTK Q06187 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
SCHEMBL30533943 1.00 CCNK (0.51) CCNKCDK12CDK13EGFRCCNA2
SCHEMBL25221073 0.92 CDK12 (0.53) CCNKCDK12CDK13EGFRCCNA2
SCHEMBL30533876 0.92 CDK12 (0.53) CCNKCDK12CDK13EGFRCCNA2
SCHEMBL30533789 0.89 CDK12 (0.56) CCNKCDK12CDK13EGFRCCNA2
SCHEMBL25268914 0.89 CDK12 (0.56) CCNKCDK12CDK13EGFRCCNA2
SCHEMBL25221756 0.88 CCNK (0.39) CCNKCDK12JAK3
SCHEMBL30533963 0.88 CCNK (0.39) CCNKCDK12JAK3
SCHEMBL25258833 0.85 CCNK (0.36) CCNKCDK12
SCHEMBL30464366 0.85 CCNK (0.36) CCNKCDK12
SCHEMBL25220788 0.81 CCNK (0.47) CCNKCDK12CDK13EGFRCCNA2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230203010-A1 BICYCLIC AMINE CDK12 INHIBITORS INCYTE CORPORATION 2023-06-29 — — US disclosed
US-20230203010-A1 BICYCLIC AMINE CDK12 INHIBITORS INCYTE CORPORATION 2023-06-29 — — US disclosed
WO-2023102184-A1 BICYCLIC AMINE COMPOUNDS AS CDK12 INHIBITORS INCYTE CORPORATION (US) 2023-06-08 — — WO disclosed
WO-2023102184-A1 BICYCLIC AMINE COMPOUNDS AS CDK12 INHIBITORS INCYTE CORPORATION (US) 2023-06-08 — — WO 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-20230203010-A1 BICYCLIC AMINE CDK12 INHIBITORS CDK12, CDK1, CDK2 CCNK 17/4885CDK12 1/4885CDK13 5/4885

“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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