SCHEMBL26341741

SCHEMBL26341741

CC(F)c1cc2cnc(N[C@H]3CCN(S(C)(=O)=O)C[C@H]3C)nc2c(N[C@H]2CCCC2(F)F)n1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CCND1 P24385 17/20 0.43
▸ CDK6 Q00534 17/20 0.43
▸ CCNE1 P24864 15/20 0.43
▸ CDK2 P24941 15/20 0.43
▸ CDK4 P11802 5/20 0.42
▸ CCND3 P30281 5/20 0.42
▸ CCNT1 O60563 1/20 0.39
▸ CCNE2 O96020 1/20 0.39
▸ RB1 P06400 1/20 0.39
▸ CDK1 P06493 1/20 0.39
▸ CCNA2 P20248 1/20 0.39
▸ CDK9 P50750 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
SCHEMBL26341740 1.00 CCND1 (0.43) CCND1CDK6CCNE1CDK2CDK4
SCHEMBL26340883 1.00 CCND1 (0.43) CCND1CDK6CCNE1CDK2CDK4
SCHEMBL26340990 0.94 CCNE1 (0.43) CCND1CDK6CCNE1CDK2CDK4
SCHEMBL26340992 0.94 CCNE1 (0.43) CCND1CDK6CCNE1CDK2CDK4
SCHEMBL26340968 0.94 CCNE1 (0.43) CCND1CDK6CCNE1CDK2CDK4
SCHEMBL26342059 0.94 CCNE1 (0.43) CCND1CDK6CCNE1CDK2CDK4
SCHEMBL26340974 0.92 CCND3 (0.47) CCND1CDK6CDK4CCND3
SCHEMBL26340889 0.92 CCND3 (0.47) CCND1CDK6CDK4CCND3
SCHEMBL26340977 0.92 CCND3 (0.47) CCND1CDK6CDK4CCND3
SCHEMBL26341737 0.92 CCND3 (0.47) CCND1CDK6CDK4CCND3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230303564-A1 PYRIMIDINE RING COMPOUND Zhejiang Yangli Pharmaceutical Technology Co., Ltd. (CN) 2023-09-28 — — 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 (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-20230303564-A1 PYRIMIDINE RING COMPOUND DPYD, TYMS, TYMP CCND1 1592/4885CDK6 221/4885CCNE1 1815/4885

“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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