SCHEMBL29558307

SCHEMBL29558307

C/C=C(\CC)c1cc(N[C@H]2CC[C@H](NC(=O)OC(C)(C)C)C2)n2ncc(Cl)c2n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK9 P50750 5/20 0.43
▸ CCNT1 O60563 4/20 0.43
▸ CDK1 P06493 3/20 0.41
▸ CDK4 P11802 3/20 0.41
▸ CCNA2 P20248 3/20 0.41
▸ CCND1 P24385 3/20 0.41
▸ CCNE1 P24864 3/20 0.41
▸ CDK2 P24941 3/20 0.41
▸ CCNA1 P78396 3/20 0.41
▸ CDK3 Q00526 3/20 0.41
▸ CDK6 Q00534 3/20 0.41
▸ CDK5 Q00535 3/20 0.41
▸ CDK5R1 Q15078 3/20 0.41
▸ CDK7 P50613 2/20 0.41
▸ CCNH P51946 2/20 0.41
▸ PIK3CD O00329 2/20 0.38
▸ BTK Q06187 2/20 0.38
▸ CCNC P24863 1/20 0.37
▸ CDK8 P49336 1/20 0.37
▸ DRD2 P14416 3/20 0.35

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
SCHEMBL29558377 0.89 CCNT1 (0.43) CDK9CCNT1CDK1CDK4CCNA2
SCHEMBL24418616 0.88 CCNT1 (0.47) CDK9CCNT1CDK1CDK4CCNA2
SCHEMBL21877653 0.87 CDK9 (0.48) CDK9CCNT1CDK1CDK4CCNA2
SCHEMBL24418662 0.85 CDK9 (0.51) CDK9CCNT1CDK1CDK4CCNA2
SCHEMBL29558494 0.84 CDK9 (0.49) CDK9CCNT1CDK1CDK4CCNA2
SCHEMBL29558303 0.83 CDK9 (0.46) CDK9CCNT1CDK1CDK4CCNA2
SCHEMBL24418615 0.81 CDK9 (0.64) CDK9CCNT1CDK1CDK4CCNA2
SCHEMBL21877674 0.81 CDK2 (0.43) CDK9CCNT1CDK1CDK4CCNA2
SCHEMBL26871370 0.80 CDK9 (0.52) CDK9CCNT1CDK1CDK4CCNA2
SCHEMBL24418649 0.80 CCNT1 (0.46) CDK9CCNT1CDK1CDK4CCNA2

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-20250188084-A1 COMPOUNDS AND METHODS FOR MODULATING CDK9 ACTIVITY Kronos Bio, Inc. (US) 2025-06-12 — — US disclosed
EP-4240422-A1 COMPOUNDS AND METHODS FOR MODULATING CDK9 ACTIVITY Kronos Bio, Inc. (US) 2023-09-13 — — EP disclosed
WO-2022098843-A1 COMPOUNDS AND METHODS FOR MODULATING CDK9 ACTIVITY Kronos Bio, Inc. (US) 2022-05-12 — — 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-20250188084-A1 COMPOUNDS AND METHODS FOR MODULATING CDK9 ACTIVITY CDK9, CDK19, CDKL1 CDK9 1/4885CCNT1 86/4885CDK1 10/4885

“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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