SCHEMBL20549658

SCHEMBL20549658

C=CC(=O)NC1CCCC(Nc2nc(NC3CCC(N(C)C)CC3)nc3c2ncn3C(C)C)C1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CDK5 Q00535 1/20 0.62
▸ CDK5R1 Q15078 1/20 0.62
▸ CDK2 P24941 10/20 0.51
▸ CDK9 P50750 2/20 0.51
▸ CDK1 P06493 2/20 0.49
▸ CCNE1 P24864 7/20 0.46
▸ CCNE2 O96020 6/20 0.46
▸ CCNA2 P20248 6/20 0.46
▸ CCNA1 P78396 6/20 0.46
▸ EGFR P00533 7/20 0.45
▸ CCNB1 P14635 1/20 0.44
▸ MAPK3 P27361 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ FLT3 P36888 1/20 0.44

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
SCHEMBL18313117 1.00 CDK5 (0.62) CDK5CDK5R1CDK2CDK9CDK1
SCHEMBL20549618 0.86 CDK5 (0.52) CDK5CDK5R1CDK2CDK9CDK1
SCHEMBL20549619 0.86 CDK5 (0.52) CDK5CDK5R1CDK2CDK9CDK1
SCHEMBL22388794 0.86 CDK5 (0.52) CDK5CDK5R1CDK2CDK9CDK1
SCHEMBL20549659 0.84 CDK2 (0.61) CDK5CDK5R1CDK2CDK9CDK1
SCHEMBL20549660 0.84 CDK2 (0.61) CDK5CDK5R1CDK2CDK9CDK1
SCHEMBL10155225 0.81 CDK5 (0.90) CDK5CDK5R1CDK2CDK1CCNE1
SCHEMBL18313492 0.81 CDK5 (0.90) CDK5CDK5R1CDK2CDK1CCNE1
SCHEMBL18122659 0.78 CDK5 (0.77) CDK5CDK5R1CDK2CDK1CCNE1
SCHEMBL20549703 0.78 CDK5 (0.77) CDK5CDK5R1CDK2CDK1CCNE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE50776-E1 Inhibitors of cyclin-dependent kinases DANA-FARBER CANCER INSTITUTE, INC. (US) 2026-02-03 — — US disclosed
US-12098154-B2 Inhibitors of cyclin-dependent kinases DANA-FARBER CANCER INSTITUTE, INC. (US) 2024-09-24 — — US disclosed
US-20230183240-A9 INHIBITORS OF CYCLIN-DEPENDENT KINASES DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-06-15 — — US disclosed
US-20230183240-A9 INHIBITORS OF CYCLIN-DEPENDENT KINASES DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-06-15 — — US disclosed
EP-3273966-B1 INHIBITORS OF CYCLIN-DEPENDENT KINASES DANA FARBER CANCER INST INC (US) 2023-05-03 — — EP disclosed
US-20220242865-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASES DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-08-04 — — US disclosed
US-11325910-B2 Inhibitors of cyclin-dependent kinases DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-05-10 — — US disclosed
CN-107427521-B Inhibitors of cyclin dependent kinases 达纳-法伯癌症研究所股份有限公司 2021-08-03 — — CN disclosed
US-20200277292-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASES DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-09-03 — — US disclosed
US-10550121-B2 Inhibitors of cyclin-dependent kinases DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-02-04 — — US disclosed
US-20190315747-A9 INHIBITORS OF CYCLIN-DEPENDENT KINASES DANA-FARBER CANCER INSTITUTE, INC. (US) 2019-10-17 — — US disclosed
US-20180319801-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASES DANA-FARBER CANCER INSTITUTE, INC. (US) 2018-11-08 — — US 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-11325910-B2 Inhibitors of cyclin-dependent kinases CDK3, CDK13, CDK1 CDK5 18/4885CDK5R1 51/4885CDK2 6/4885
US-20220242865-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASES CDK3, CDK13, CDK1 CDK5 18/4885CDK5R1 51/4885CDK2 6/4885
US-20200277292-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASES CDK3, CDK13, CDK1 CDK5 18/4885CDK5R1 51/4885CDK2 6/4885
US-10550121-B2 Inhibitors of cyclin-dependent kinases CDK3, CDK13, CDK1 CDK5 18/4885CDK5R1 51/4885CDK2 6/4885
US-20180319801-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASES CDK3, CDK13, CDK1 CDK5 18/4885CDK5R1 51/4885CDK2 6/4885
US-12098154-B2 Inhibitors of cyclin-dependent kinases CDK3, CDK13, CDK1 CDK5 18/4885CDK5R1 51/4885CDK2 6/4885
US-20190315747-A9 INHIBITORS OF CYCLIN-DEPENDENT KINASES CDK3, CDK13, CDK1 CDK5 18/4885CDK5R1 51/4885CDK2 6/4885
US-20230183240-A9 INHIBITORS OF CYCLIN-DEPENDENT KINASES CDK3, CDK13, CDK1 CDK5 18/4885CDK5R1 51/4885CDK2 6/4885

“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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