SCHEMBL24710109

SCHEMBL24710109

Cn1cc(-c2nc(Nc3ccc(CN4CCN(C(=O)OC(C)(C)C)CC4)cn3)ncc2F)c2cccnc21

nearest known ligand 0.74

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CCND1 P24385 20/20 0.74
▸ CDK6 Q00534 20/20 0.74
▸ CDK4 P11802 1/20 0.63

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
SCHEMBL24710253 0.92 CCND1 (0.75) CCND1CDK6CDK4
SCHEMBL24710258 0.88 CCND1 (0.70) CCND1CDK6CDK4
SCHEMBL24710251 0.87 CCND1 (0.74) CCND1CDK6CDK4
SCHEMBL24710256 0.86 CDK6 (1.00) CCND1CDK6CDK4
SCHEMBL24710111 0.83 CCND1 (1.00) CCND1CDK6CDK4
SCHEMBL24710588 0.80 CCND1 (0.71) CCND1CDK6CDK4
SCHEMBL24710417 0.80 CCND1 (0.81) CCND1CDK6
SCHEMBL28590008 0.79 CDK6 (0.70) CCND1CDK6CDK4
SCHEMBL24710263 0.79 CCND1 (0.81) CCND1CDK6
SCHEMBL28591505 0.78 CDK6 (0.74) CCND1CDK6CDK4

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
WO-2022257568-A1 AZAINDOLE PYRIMIDINAMINE HETEROCYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF 中国药科大学 2022-12-15 — — WO disclosed
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