SCHEMBL14175403

SCHEMBL14175403

CCCC(CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)n1cnc2c(NC)ncnc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNB2 O95067 6/20 0.40
CDK1 P06493 6/20 0.40
CCNB1 P14635 6/20 0.40
CCNB3 Q8WWL7 6/20 0.40
CDK2 P24941 1/20 0.40
PDE4A P27815 3/20 0.38
PDE4B Q07343 3/20 0.38
PDE4C Q08493 3/20 0.38
PDE4D Q08499 3/20 0.38
PDE5A O76074 2/20 0.37
PDE1A P54750 2/20 0.37
PDE1B Q01064 2/20 0.37
PDE3B Q13370 2/20 0.37
PDE1C Q14123 2/20 0.37
PDE3A Q14432 2/20 0.37
YTHDC1 Q96MU7 1/20 0.36
TMIGD3 P0DMS9 2/20 0.35
ADORA2A P29274 2/20 0.35
ADORA1 P30542 2/20 0.35
P2RY1 P47900 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
SCHEMBL14175391 0.78 ADORA2A (0.41) ADORA2AADORA1
SCHEMBL14175398 0.75 YTHDC1 (0.48) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL14175392 0.75 ABCB11 (0.42)
SCHEMBL14175402 0.73 P2RY1 (0.47) CCNB2CDK1CCNB1CCNB3PDE4A
SCHEMBL5083628 0.71 ADORA2A (0.49) ADORA2AADORA1
SCHEMBL21755892 0.71 CCNB2 (0.56) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL22166089 0.71 CCNB2 (0.56) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL14175400 0.70 P2RY1 (0.41) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL14175380 0.70 CDK1 (0.41) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL5083559 0.69 CDK1 (0.35) 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-7388002-B2 Nucleosides, preparation thereof and use as inhibitors of RNA viral polymerases BIOCRYST PHARMACEUTICALS, INC. (US) 2008-06-17 US disclosed