SCHEMBL17141895

SCHEMBL17141895

C=CC(=O)N1CCC(C(=O)Nc2ncc(SCc3ncc(C(C)(C)C)o3)s2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 17/20 1.00
▸ CDK9 P50750 11/20 1.00
▸ CDK7 P50613 5/20 1.00
▸ CCNT1 O60563 4/20 1.00
▸ CCNH P51946 4/20 1.00
▸ MNAT1 P51948 3/20 1.00
▸ CCNA1 P78396 3/20 1.00
▸ CCNE2 O96020 7/20 0.77
▸ CCNE1 P24864 7/20 0.77
▸ CDK1 P06493 2/20 0.70
▸ CCNB1 P14635 2/20 0.70
▸ CIT O14578 1/20 0.70
▸ CASK O14936 1/20 0.70
▸ AURKA O14965 1/20 0.70
▸ GAK O14976 1/20 0.70
▸ DCLK1 O15075 1/20 0.70
▸ MAP3K7 O43318 1/20 0.70
▸ ULK1 O75385 1/20 0.70
▸ RPS6KA5 O75582 1/20 0.70
▸ PAK3 O75914 1/20 0.70

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
SCHEMBL17141859 0.97 CDK2 (0.95) CDK2CDK9CDK7CCNT1CCNH
SCHEMBL17141906 0.94 CDK2 (0.88) CDK2CDK9CDK7CCNT1CCNH
SCHEMBL17148410 0.91 CDK2 (0.84) CDK2CDK9CDK7CCNT1CCNH
SCHEMBL17141909 0.88 CDK2 (0.78) CDK2CDK9CDK7CCNT1CCNH
SCHEMBL20583289 0.88 CDK2 (1.00) CDK2CDK9CDK7CCNT1CCNH
SCHEMBL20583285 0.88 CDK2 (1.00) CDK2CDK9CDK7CCNT1CCNH
SCHEMBL20905302 0.87 CDK2 (1.00) CDK2CDK9CDK7CCNT1CCNH
SCHEMBL24758127 0.87 CDK2 (0.79) CDK2CDK9CDK7CCNT1CCNH
SCHEMBL4215831 0.87 CDK2 (0.79) CDK2CDK9CDK7CCNT1CCNH
SCHEMBL22272062 0.87 CDK2 (0.81) CDK2CDK9CDK7CCNT1CCNH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230114207-A1 THE COMBINATION OF CYCLIN DEPENDENT KINASE 7 INHIBITOR AND IMMUNOTHERAPY FOR TREATMENT OF CANCER DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-04-13 — — US disclosed
EP-4019515-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASES Dana-Farber Cancer Institute, Inc. (US) 2022-06-29 — — EP disclosed
EP-4019515-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASES Dana-Farber Cancer Institute, Inc. (US) 2022-06-29 — — EP disclosed
US-20220055998-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASES DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-02-24 — — US disclosed
US-20220055998-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASES DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-02-24 — — US disclosed
US-11142507-B2 Inhibitors of cyclin-dependent kinases DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-10-12 — — US disclosed
US-11142507-B2 Inhibitors of cyclin-dependent kinases DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-10-12 — — US disclosed
US-20210221814-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) SYROS PHARMACEUTICALS, INC. 2021-07-22 — — US disclosed
US-20210221814-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) SYROS PHARMACEUTICALS, INC. 2021-07-22 — — US disclosed
US-20210107912-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) SYROS PHARMACEUTICALS, INC. 2021-04-15 — — US disclosed
US-20190330218-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) SYROS PHARMACEUTICALS INC (US) 2019-10-31 — — US disclosed
US-10336760-B2 Inhibitors of cyclin-dependent kinase 7 (CDK7) SYROS PHARMACEUTICALS, INC. (US) 2019-07-02 — — US disclosed
US-10336760-B2 Inhibitors of cyclin-dependent kinase 7 (CDK7) SYROS PHARMACEUTICALS, INC. (US) 2019-07-02 — — US disclosed
WO-2019035866-A1 COMPOSITIONS AND METHODS FOR TREATING TUBEROUS SCLEROSIS COMPLEX THE BRIGHAM & WOMEN'S HOSPITAL, INC. (US) 2019-02-21 — — WO disclosed
US-20170174692-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) OXFORD FINANCE LLC, AS COLLATERAL AGENT 2017-06-22 — — US disclosed
US-20170174692-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) OXFORD FINANCE LLC, AS COLLATERAL AGENT 2017-06-22 — — US disclosed
US-20170174692-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) OXFORD FINANCE LLC, AS COLLATERAL AGENT 2017-06-22 — — US disclosed
EP-3129371-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) Syros Pharmaceuticals, Inc. (US) 2017-02-15 — — EP disclosed
WO-2015154022-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) SYROS PHARMACEUTICALS, INC. (US) 2015-10-08 — — WO disclosed
WO-2015154022-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) SYROS PHARMACEUTICALS, INC. (US) 2015-10-08 — — 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 (8 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-11142507-B2 Inhibitors of cyclin-dependent kinases CDK1, CDK13, CDK3 CDK2 5/4885CDK9 22/4885CDK7 9/4885
US-10336760-B2 Inhibitors of cyclin-dependent kinase 7 (CDK7) CDK7, CDK3, CDK9 CDK2 8/4885CDK9 3/4885CDK7 1/4885
US-20170174692-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) CDK7, CDK3, CDK9 CDK2 8/4885CDK9 3/4885CDK7 1/4885
US-20210107912-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) CDK7, CDK3, CDK9 CDK2 8/4885CDK9 3/4885CDK7 1/4885
US-20210221814-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) CDK7, CDK3, CDK9 CDK2 8/4885CDK9 3/4885CDK7 1/4885
US-20190330218-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) CDK7, CDK3, CDK9 CDK2 8/4885CDK9 3/4885CDK7 1/4885
US-20220055998-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASES CDK1, CDK13, CDK3 CDK2 5/4885CDK9 22/4885CDK7 9/4885
US-20230114207-A1 THE COMBINATION OF CYCLIN DEPENDENT KINASE 7 INHIBITOR AND IMMUNOTHERAPY FOR TREATMENT OF CANCER CDK7, CDC7, CDK8 CDK2 17/4885CDK9 5/4885CDK7 1/4885

“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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