SCHEMBL17459809

SCHEMBL17459809

CC(C)c1c2cc(-c3nc(Cl)ncc3F)ccc2nn1C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK6 Q00534 13/20 0.54
▸ CDK4 P11802 11/20 0.54
▸ CCND1 P24385 11/20 0.54
▸ CDK9 P50750 9/20 0.54
▸ CCNT1 O60563 8/20 0.54
▸ CDK2 P24941 4/20 0.54
▸ CDK1 P06493 3/20 0.54
▸ CCNB1 P14635 2/20 0.54
▸ CCNE1 P24864 2/20 0.54
▸ CDK5 Q00535 2/20 0.54
▸ CDK5R1 Q15078 2/20 0.54
▸ CYP2C9 P11712 1/20 0.54
▸ CYP2C19 P33261 1/20 0.54
▸ KCNH2 Q12809 1/20 0.54
▸ CCND3 P30281 3/20 0.43
▸ CDK8 P49336 3/20 0.39
▸ CCNC P24863 2/20 0.39
▸ CDK7 P50613 2/20 0.39
▸ CCNH P51946 2/20 0.39
▸ MNAT1 P51948 1/20 0.39

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
SCHEMBL24304984 0.87 CDK4 (0.55) CDK6CDK4CCND1CDK9CCNT1
SCHEMBL18081420 0.86 CDK4 (0.54) CDK6CDK4CCND1CDK9CCNT1
SCHEMBL17469717 0.86 CDK4 (0.54) CDK6CDK4CCND1CDK9CCNT1
SCHEMBL21345115 0.84 CDK6 (0.61) CDK6CDK4CCND1CDK9CCNT1
SCHEMBL22650377 0.82 CDK6 (0.38) CDK6CDK4CCND1CDK9CCNT1
SCHEMBL21345192 0.81 CDK6 (0.61) CDK6CDK4CCND1CDK9CCNT1
SCHEMBL18081413 0.81 CDK6 (0.40) CDK6CDK4CCND1CDK9CCNT1
SCHEMBL18081385 0.80 CDK4 (0.44) CDK6CDK4CCND1CDK9CCNT1
SCHEMBL20740537 0.78 JAK2 (0.38) CDK6CDK4CCND1CDK9CCNT1
SCHEMBL20356534 0.78 CDK6 (0.37) CDK6CDK4CCND1CDK9CCNT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12595246-B2 Crystalline and amorphous forms of N-(5-((4-ethylpiperazin-1-yl)methyl)pyridine-2-yl)-5-fluoro-4-(3-isopropyl-2-methyl-2H-indazol-5-yl)pyrimidin-2-amine and its salts, and preparation methods and therapeutic uses thereof BETA PHARMA, INC. (US) 2026-04-07 — — US disclosed
CN-111333627-B Substituted 2-hydro-pyrazole derivatives as anticancer agents 正大天晴药业集团股份有限公司 2024-09-13 — — CN disclosed
EP-3941472-B1 CRYSTALLINE AND AMORPHOUS FORMS OF-(5-((4-ETHYLPIPERAZIN-1-YL)METHYL)PYRIDINE-2-YL)-5-FLUORO-4-(3-ISOPROPYL-2-METHYL-2 <NS1:I>H</NS1:I>?-INDAZOL-5-YL)PYRIMIDIN-2-AMINE AND ITS SALTS, AND PREPARATION METHODS AND THERAPEUTIC USES THEREOF BETA PHARMA INC (US) 2024-07-10 — — EP disclosed
CN-113840605-B Crystalline forms of N- (5- ((4-ethylpiperazin-1-yl) methyl) pyridin-2-yl) -5-fluoro-4- (3-isopropyl-2-methyl-2H-indazol-5-yl) pyrimidin-2-amine hydrochloride and uses thereof 贝达医药公司 2024-05-28 — — CN disclosed
US-20230331699-A1 PREPARATION METHOD FOR CDK4/6 INHIBITOR CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2023-10-19 — — US disclosed
EP-3746072-B1 2H-INDAZOLE DERIVATIVES AS CDK4 AND CDK6 INHIBITORS AND THERAPEUTIC USES THEREOF BETA PHARMA INC (US) 2023-04-12 — — EP disclosed
EP-3746072-B1 2H-INDAZOLE DERIVATIVES AS CDK4 AND CDK6 INHIBITORS AND THERAPEUTIC USES THEREOF BETA PHARMA INC (US) 2023-04-12 — — EP disclosed
US-11352341-B2 2H-indazole derivatives as CDK4 and CDK6 inhibitors and therapeutic uses thereof BETA PHARMA, INC. (US) 2022-06-07 — — US disclosed
US-11352341-B2 2H-indazole derivatives as CDK4 and CDK6 inhibitors and therapeutic uses thereof BETA PHARMA, INC. (US) 2022-06-07 — — US disclosed
US-20220162185-A1 CRYSTALLINE AND AMORPHOUS FORMS OF N-(5-((4-ETHYLPIPERAZIN-1-YL)METHYL)PYRIDINE-2-YL)-5-FLUORO-4-(3-ISOPROPYL-2-METHYL-2H-INDAZOL-5-YL)PYRIMIDIN-2-AMINE AND ITS SALTS, AND PREPARATION METHODS AND THERAPEUTIC USES THEREOF BETA PHARMA, INC. 2022-05-26 — — US disclosed
US-9878994-B2 2-H-indazole derivatives as cyclin-dependent kinase (CDK) inhibitors and therapeutic uses thereof BETA PHARMA INC. (US) 2018-01-30 — — US disclosed
US-9878994-B2 2-H-indazole derivatives as cyclin-dependent kinase (CDK) inhibitors and therapeutic uses thereof BETA PHARMA INC. (US) 2018-01-30 — — US disclosed
US-9878994-B2 2-H-indazole derivatives as cyclin-dependent kinase (CDK) inhibitors and therapeutic uses thereof BETA PHARMA INC. (US) 2018-01-30 — — US disclosed
US-20170210726-A1 2-H-INDAZOLE DERIVATIVES AS CYCLIN-DEPENDENT KINASE (CDK) INHIBITORS AND THERAPEUTIC USES THEREOF BETA PHARMA, INC. (US) 2017-07-27 — — US disclosed
US-20170210726-A1 2-H-INDAZOLE DERIVATIVES AS CYCLIN-DEPENDENT KINASE (CDK) INHIBITORS AND THERAPEUTIC USES THEREOF BETA PHARMA, INC. (US) 2017-07-27 — — US disclosed
US-20170210726-A1 2-H-INDAZOLE DERIVATIVES AS CYCLIN-DEPENDENT KINASE (CDK) INHIBITORS AND THERAPEUTIC USES THEREOF BETA PHARMA, INC. (US) 2017-07-27 — — US disclosed
EP-3191469-A1 2-H-INDAZOLE DERIVATIVES AS CYCLIN-DEPENDENT KINASE (CDK) INHIBITORS AND THERAPEUTIC USES THEREOF Beta Pharma, Inc. (US) 2017-07-19 — — EP disclosed
WO-2016141881-A1 SUBSTITUTED 2-HYDROGEN-PYRAZOLE DERIVATIVE SERVING AS ANTICANCER DRUG 南京明德新药研发股份有限公司 2016-09-15 — — WO disclosed
WO-2016014904-A1 2-H-INDAZOLE DERIVATIVES AS CYCLIN-DEPENDENT KINASE (CDK) INHIBITORS AND THERAPEUTIC USES THEREOF BETA PHARMA, INC. (US) 2016-01-28 — — WO disclosed
WO-2016014904-A1 2-H-INDAZOLE DERIVATIVES AS CYCLIN-DEPENDENT KINASE (CDK) INHIBITORS AND THERAPEUTIC USES THEREOF BETA PHARMA, INC. (US) 2016-01-28 — — 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-11352341-B2 2H-indazole derivatives as CDK4 and CDK6 inhibitors and therapeutic uses thereof CDK4, CDK6, CDK3 CDK6 2/4885CDK4 1/4885CCND1 24/4885
US-20220162185-A1 CRYSTALLINE AND AMORPHOUS FORMS OF N-(5-((4-ETHYLPIPERAZIN-1-YL)METHYL)PYRIDINE-2-YL)-5-FLUORO-4-(3-ISOPROPYL-2-METHYL-2H-INDAZOL-5-YL)PYRIMIDIN-2-AMINE AND ITS SALTS, AND PREPARATION METHODS AND THERAPEUTIC USES THEREOF CDK6, CDK4, CDK2 CDK6 1/4885CDK4 2/4885CCND1 49/4885
US-20230331699-A1 PREPARATION METHOD FOR CDK4/6 INHIBITOR CDK4, CDK6, CDK2 CDK6 2/4885CDK4 1/4885CCND1 36/4885
US-12595246-B2 Crystalline and amorphous forms of N-(5-((4-ethylpiperazin-1-yl)methyl)pyridine-2-yl)-5-fluoro-4-(3-isopropyl-2-methyl-2H-indazol-5-yl)pyrimidin-2-amine and its salts, and preparation methods and therapeutic uses thereof CDK6, CDK4, CDK2 CDK6 1/4885CDK4 2/4885CCND1 27/4885
US-20170210726-A1 2-H-INDAZOLE DERIVATIVES AS CYCLIN-DEPENDENT KINASE (CDK) INHIBITORS AND THERAPEUTIC USES THEREOF CDK4, CDK3, CDK6 CDK6 3/4885CDK4 1/4885CCND1 35/4885

“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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