SCHEMBL24477884

SCHEMBL24477884

Cn1cc(S(=O)(=O)N2CCC(Nc3ncc(Br)c(O[C@@H]4CCCC[C@@H]4O)n3)CC2)cn1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 20/20 0.51
▸ CCNE1 P24864 12/20 0.51
▸ CCND1 P24385 5/20 0.49
▸ CDK6 Q00534 5/20 0.49
▸ CDK1 P06493 4/20 0.46
▸ CCNB1 P14635 4/20 0.46
▸ CCNT1 O60563 1/20 0.46
▸ CDK4 P11802 1/20 0.46
▸ CCND3 P30281 1/20 0.46
▸ CDK7 P50613 1/20 0.46
▸ CDK9 P50750 1/20 0.46
▸ CCNH P51946 1/20 0.46
▸ MNAT1 P51948 1/20 0.46
▸ CCNB2 O95067 3/20 0.43
▸ CCNE2 O96020 3/20 0.43
▸ CDK5 Q00535 3/20 0.43
▸ CDK5R1 Q15078 3/20 0.43
▸ CCNB3 Q8WWL7 3/20 0.43
▸ CCNA2 P20248 8/20 0.41
▸ CCNK O75909 2/20 0.38

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
SCHEMBL24477887 1.00 CDK2 (0.51) CDK2CCNE1CCND1CDK6CDK1
SCHEMBL25665857 0.91 CDK2 (0.52) CDK2CCNE1CCND1CDK6CDK1
SCHEMBL26942215 0.86 CDK2 (0.51) CDK2CCNE1CCND1CDK6CDK1
SCHEMBL26942213 0.86 CDK2 (0.51) CDK2CCNE1CCND1CDK6CDK1
SCHEMBL26942216 0.86 CDK2 (0.51) CDK2CCNE1CCND1CDK6CDK1
SCHEMBL26942269 0.86 CDK2 (0.51) CDK2CCNE1CCND1CDK6CDK1
SCHEMBL24477892 0.85 CCNE1 (0.49) CDK2CCNE1CCND1CDK6CCNT1
SCHEMBL24477652 0.85 CCNE1 (0.49) CDK2CCNE1CCND1CDK6CCNT1
SCHEMBL24477786 0.85 CCNE1 (0.49) CDK2CCNE1CCND1CDK6CCNT1
SCHEMBL26942929 0.77 CDK2 (0.57) CDK2CCNE1CCND1CDK6CDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023093769-A1 AMINOHETEROARYL KINASE INHIBITORS ANRUI BIOMEDICAL TECHNOLOGY (GUANGZHOU) CO.,LTD. (CN) 2023-06-01 — — WO disclosed
WO-2022111621-A1 AMINOHETEROARYL KINASE INHIBITORS ANRUI BIOMEDICAL TECHNOLOGY (GUANGZHOU) CO., LTD. (CN) 2022-06-02 — — WO disclosed
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