SCHEMBL30504220

SCHEMBL30504220

O=C(Nc1ncnc2c1ncn2[C@H](O)[C@H](O)[C@H](F)CCO)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CCNB2 O95067 5/20 0.39
▸ CDK1 P06493 5/20 0.39
▸ CCNB1 P14635 5/20 0.39
▸ CCNB3 Q8WWL7 5/20 0.39
▸ CDK2 P24941 1/20 0.39
▸ PRMT6 Q96LA8 1/20 0.37
▸ BRD4 O60885 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ ADORA3 P0DMS8 1/20 0.36
▸ ADORA2A P29274 1/20 0.36
▸ ADORA1 P30542 1/20 0.36
▸ CSF1R P07333 1/20 0.35
▸ AURKA O14965 1/20 0.34
▸ RPS6KB1 P23443 1/20 0.34

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
SCHEMBL30504224 0.84 PRMT6 (0.37) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL15426097 0.83 CCNB2 (0.42) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL24722333 0.82 CCNB2 (0.41) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL22990588 0.81 CDK1 (0.41) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL20857311 0.78 CCNB2 (0.39) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL2718523 0.78 CDK1 (0.59) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL18521958 0.75 CCNB2 (0.42) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL20052944 0.75 AHCY (0.43) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL9702446 0.74 CYP1A2 (0.51) CDK1HTTADORA3ADORA2AADORA1
SCHEMBL23046742 0.74 CCNB2 (0.39) 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
CN-111263767-B Cyclic dinucleotides as stimulators of interferon gene modulators 北京轩义医药科技有限公司 2023-07-18 — — CN disclosed
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