SCHEMBL26230985

SCHEMBL26230985

C[C@H](CO)C[C@H](CO)n1cnc2c(NC(=O)c3ccccc3)ncnc21

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CCNB2 O95067 9/20 0.45
▸ CDK1 P06493 9/20 0.45
▸ CCNB1 P14635 9/20 0.45
▸ CCNB3 Q8WWL7 9/20 0.45
▸ CDK2 P24941 1/20 0.45
▸ ADORA3 P0DMS8 1/20 0.39
▸ ADORA2A P29274 1/20 0.39
▸ ADORA1 P30542 1/20 0.39
▸ BRD4 O60885 1/20 0.38
▸ PRMT6 Q96LA8 1/20 0.37

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
SCHEMBL26230986 0.90 CCNB2 (0.40) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL15426097 0.86 CCNB2 (0.42) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL2718523 0.84 CDK1 (0.59) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL20052009 0.81 CCNB2 (0.44) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL22571176 0.80 CCNB2 (0.46) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL18521958 0.79 CCNB2 (0.42) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL20052944 0.78 AHCY (0.43) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL22571188 0.78 CCNB2 (0.44) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL29259454 0.78 CCNB2 (0.42) CCNB2CDK1CCNB1CCNB3ADORA3
SCHEMBL24722333 0.77 CCNB2 (0.41) CCNB2CDK1CCNB1CCNB3CDK2

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-20230287418-A1 MODIFIED SIRNA WITH REDUCED OFF-TARGET ACTIVITY TUOJIE BIOTECH(SHANGHAI) CO., LTD. (CN) 2023-09-14 — — US disclosed
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