SCHEMBL6250265

SCHEMBL6250265

C[Si](C)(C)c1cnc(C=Cc2cnc(NC(=O)Cc3cccnc3)s2)o1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCNE1 P24864 11/20 0.50
▸ CDK2 P24941 11/20 0.50
▸ CDK1 P06493 3/20 0.50
▸ CDK4 P11802 3/20 0.50
▸ CCNB1 P14635 3/20 0.50
▸ CCND1 P24385 3/20 0.50
▸ CCNE2 O96020 3/20 0.50
▸ CCNB2 O95067 2/20 0.50
▸ CCNB3 Q8WWL7 2/20 0.50
▸ CCND2 P30279 1/20 0.50
▸ CCND3 P30281 1/20 0.50
▸ GLS O94925 6/20 0.47
▸ CDK5 Q00535 8/20 0.45
▸ CCNT1 O60563 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ CCNA2 P20248 1/20 0.42
▸ CDK7 P50613 1/20 0.42
▸ CDK9 P50750 1/20 0.42
▸ CCNH P51946 1/20 0.42
▸ MNAT1 P51948 1/20 0.42

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
SCHEMBL6250263 1.00 CCNE1 (0.50) CCNE1CDK2CDK1CDK4CCNB1
SCHEMBL5725374 0.89 CDK2 (0.62) CCNE1CDK2CDK1CDK4CCNB1
SCHEMBL5725115 0.89 CCNE1 (0.49) CCNE1CDK2CDK1CDK4CCNB1
SCHEMBL5725122 0.89 CCNE1 (0.49) CCNE1CDK2CDK1CDK4CCNB1
SCHEMBL5725069 0.89 CDK2 (0.62) CCNE1CDK2CDK1CDK4CCNB1
SCHEMBL5725059 0.89 CDK2 (0.62) CCNE1CDK2CDK1CDK4CCNB1
SCHEMBL6248651 0.82 RAB9A (0.46) CCNE1CDK2CDK5ALDH1A1SMN1; SMN2
SCHEMBL6248648 0.82 RAB9A (0.46) CCNE1CDK2CDK5ALDH1A1SMN1; SMN2
SCHEMBL6250103 0.81 CCNE1 (0.55) CCNE1CDK2CDK1CDK4CCNB1
SCHEMBL5725166 0.78 CDK2 (0.60) CCNE1CDK2CDK1CDK4CCNB1

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-2005035541-A1 SILICON COMPOUNDS AND THEIR USE AMEDIS PHARMACEUTICALS LTD. (GB) 2005-04-21 — — WO claimed
WO-2005035541-A1 SILICON COMPOUNDS AND THEIR USE AMEDIS PHARMACEUTICALS LTD. (GB) 2005-04-21 — — WO disclosed
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