SCHEMBL26941552

SCHEMBL26941552

CS(=O)(=O)N1CCC(Nc2ncc(C(F)(F)F)c(NC3CCCC3)n2)CC1

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ULK1 O75385 1/20 0.67
▸ CCNE1 P24864 17/20 0.64
▸ CDK2 P24941 17/20 0.64
▸ CCND1 P24385 13/20 0.64
▸ CDK6 Q00534 13/20 0.64
▸ CDK4 P11802 10/20 0.64
▸ CDK1 P06493 7/20 0.64
▸ CCNB1 P14635 7/20 0.64
▸ CCND3 P30281 7/20 0.64
▸ PTK2 Q05397 1/20 0.59
▸ MAPK3 P27361 1/20 0.56
▸ CCNE2 O96020 1/20 0.54
▸ CCNT1 O60563 3/20 0.53
▸ CDK9 P50750 3/20 0.53

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
SCHEMBL22901105 0.84 CCNE1 (0.65) CCNE1CDK2CCND1CDK6CDK4
SCHEMBL29631651 0.84 CCNE1 (0.65) CCNE1CDK2CCND1CDK6CDK4
SCHEMBL26941950 0.84 CDK2 (0.65) ULK1CCNE1CDK2CCND1CDK6
SCHEMBL26941973 0.83 CCNE1 (0.65) ULK1CCNE1CDK2CCND1CDK6
SCHEMBL26941919 0.83 CCNE1 (0.62) CCNE1CDK2CCND1CDK6CDK4
SCHEMBL24477774 0.82 CDK2 (0.63) CCNE1CDK2CCND1CDK6CDK4
SCHEMBL30906911 0.82 CCNE1 (0.63) CCNE1CDK2CCND1CDK6CDK4
SCHEMBL27213238 0.82 CCNE1 (0.63) CCNE1CDK2CCND1CDK6CDK4
SCHEMBL24477959 0.82 CDK2 (0.61) CCNE1CDK2CCND1CDK6CDK4
SCHEMBL26943498 0.82 ULK1 (0.57) ULK1CCNE1CDK2CCND1CDK6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250009745-A1 CDK INHIBITOR SHANGHAI QILU PHARMACEUTICAL RESEARCH AND DEVELOPMENT CENTRE LTD. (CN) 2025-01-09 — — US disclosed
EP-4289835-A1 CDK INHIBITOR Shanghai Qilu Pharmaceutical Research and Development Centre Ltd. (CN) 2023-12-13 — — EP disclosed
EP-4289835-A1 CDK INHIBITOR Shanghai Qilu Pharmaceutical Research and Development Centre Ltd. (CN) 2023-12-13 — — EP disclosed
WO-2022166793-A1 CDK INHIBITOR 上海齐鲁制药研究中心有限公司 2022-08-11 — — 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-20250009745-A1 CDK INHIBITOR CDK9, CDKL1, CDK6 ULK1 1250/4885CCNE1 32/4885CDK2 11/4885

“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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