SCHEMBL22286736

SCHEMBL22286736

CC(C)(C)n1nc([C@H]2CC[C@@H](O[Si](C)(C)C(C)(C)C)C2)cc1N

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CCNE1 P24864 6/20 0.37
▸ CDK2 P24941 6/20 0.37
▸ GSK3B P49841 4/20 0.34
▸ CYP3A4 P08684 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ TGFBR1 P36897 1/20 0.31

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
SCHEMBL24741966 1.00 CCNE1 (0.37) CCNE1CDK2GSK3BCYP3A4GAA
SCHEMBL31028793 1.00 CCNE1 (0.37) CCNE1CDK2GSK3BCYP3A4GAA
SCHEMBL22312645 0.86 CCNE1 (0.35) CCNE1CDK2GSK3BCYP3A4GAA
SCHEMBL29987604 0.82 CCNE1 (0.39) CCNE1CDK2GSK3BCYP3A4GAA
SCHEMBL17387673 0.79 CYP3A4 (0.43) CYP3A4GAACYP2C19TGFBR1
SCHEMBL2419398 0.79 CYP3A4 (0.43) CYP3A4GAACYP2C19TGFBR1
SCHEMBL25345989 0.79 — —
SCHEMBL25348163 0.79 — —
SCHEMBL31059664 0.79 — —
SCHEMBL25348190 0.79 — —

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 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4587438-A1 BICYCLIC COMPOUNDS AS CDK INHIBITORS BeiGene Switzerland GmbH (CH) 2025-07-23 — — EP disclosed
WO-2025136671-A1 ANILINO-PYRAZOLE DERIVATIVES, COMPOSITIONS AND METHODS THEREOF ENSEM THERAPEUTICS, INC. (US) 2025-06-26 — — WO disclosed
CN-119894890-A Bicyclic compounds as CDK inhibitors 百济神州(苏州)生物科技有限公司 2025-04-25 — — CN disclosed
EP-4540230-A1 ANILINO-PYRAZOLE DERIVATIVES, COMPOSITIONS AND METHODS THEREOF Ensem Therapeutics, Inc. (US) 2025-04-23 — — EP disclosed
CN-119384413-A Anilino-pyrazole derivatives, compositions and methods thereof 昂胜医药有限公司 2025-01-28 — — CN disclosed
US-20240425478-A1 CYCLOPENTYLPYRAZOLE CDK2 INHIBITORS GENENTECH INC (US) 2024-12-26 — — US disclosed
US-20240317777-A1 NOVEL MACROCYCLIC AMINOPYRAZOLE COMPOUNDS AS CDK2 INHIBITORS ACCUTAR BIOTECHNOLOGY INC. (US) 2024-09-26 — — US disclosed
US-20240294506-A1 CDK2 INHIBITORS PFIZER INC. (US) 2024-09-05 — — US disclosed
WO-2024178335-A2 NOVEL MACROCYCLIC AMINOPYRAZOLE COMPOUNDS AS CDK2 INHIBITORS ACCUTAR BIOTECHNOLOGY, INC. (US) 2024-08-29 — — WO disclosed
EP-4412995-A1 CYCLOPENTYLPYRAZOLE CDK2 INHIBITORS Genentech, Inc. (US) 2024-08-14 — — EP disclosed
CN-115806551-A Pyrazole-containing polycyclic derivative, pharmaceutically acceptable salt thereof, and preparation method and application thereof 优领医药科技(香港)有限公司 2023-03-17 — — CN disclosed
WO-2022206888-A1 CDK2 INHIBITORS AND USE THEREOF QILU REGOR THERAPEUTICS INC. (CN) 2022-10-06 — — WO disclosed
WO-2022018596-A1 COMBINATION THERAPY PFIZER INC. (US) 2022-01-27 — — WO disclosed
WO-2022018667-A1 COMBINATION THERAPIES USING CDK2 AND CDC25A INHIBITORS PFIZER INC. (US) 2022-01-27 — — WO disclosed
EP-3917913-A2 3-CARBONYLAMINO-5-CYCLOPENTYL-1H-PYRAZOLE COMPOUNDS HAVING INHIBITORY ACTIVITY ON CDK2 Pfizer Inc. (US) 2021-12-08 — — EP disclosed
US-11014911-B2 CDK2 inhibitors PFIZER INC. (US) 2021-05-25 — — US disclosed
US-11014911-B2 CDK2 inhibitors PFIZER INC. (US) 2021-05-25 — — US disclosed
US-20200247784-A1 CDK2 INHIBITORS PFIZER INC. (US) 2020-08-06 — — US disclosed
US-20200247784-A1 CDK2 INHIBITORS PFIZER INC. (US) 2020-08-06 — — US disclosed
WO-2020157652-A2 CDK2 INHIBITORS PFIZER INC. (US) 2020-08-06 — — 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 (5 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-20240425478-A1 CYCLOPENTYLPYRAZOLE CDK2 INHIBITORS CDK2, CCNI, CDK20 CCNE1 26/4885CDK2 1/4885GSK3B 182/4885
US-20200247784-A1 CDK2 INHIBITORS CDK2, CDK1, CCNI CCNE1 8/4885CDK2 1/4885GSK3B 114/4885
US-20240294506-A1 CDK2 INHIBITORS CDK2, CDK1, CCNI CCNE1 8/4885CDK2 1/4885GSK3B 114/4885
US-20240317777-A1 NOVEL MACROCYCLIC AMINOPYRAZOLE COMPOUNDS AS CDK2 INHIBITORS CDK2, CDK20, CDK3 CCNE1 43/4885CDK2 1/4885GSK3B 117/4885
US-11014911-B2 CDK2 inhibitors CDK2, CDK1, CCNI CCNE1 8/4885CDK2 1/4885GSK3B 114/4885

“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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