SCHEMBL5080069

SCHEMBL5080069

CCNc1ncnc2c1ncn2C(O)(CC)COC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 3/20 0.40
TMIGD3 P0DMS9 4/20 0.40
ADORA2A P29274 4/20 0.40
ADORA1 P30542 4/20 0.40
ADORA2B P29275 1/20 0.40
TYMP P19971 1/20 0.39
CCNB2 O95067 2/20 0.38
CCNB1 P14635 2/20 0.38
CCNB3 Q8WWL7 2/20 0.38
CDK2 P24941 2/20 0.38
HTT P42858 1/20 0.38
ADORA3 P0DMS8 1/20 0.37
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
MAPK1 P28482 1/20 0.35
MAPK8 P45983 1/20 0.35
CSNK1A1 P48729 1/20 0.35
CSNK1D P48730 1/20 0.35
CDK7 P50613 1/20 0.35
CCNH P51946 1/20 0.35

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
SCHEMBL5080090 0.89 RAB9A (0.40) CDK1TMIGD3ADORA2AADORA1ADORA2B
SCHEMBL5083000 0.86 ADORA1 (0.41) ADORA2AADORA1ADORA2BADORA3
SCHEMBL5082973 0.85 ADORA1 (0.46) ADORA2AADORA1ADORA2BADORA3
SCHEMBL5083021 0.85 ADORA1 (0.47) ADORA2AADORA1ADORA2BADORA3
SCHEMBL5082276 0.82 SMN1; SMN2 (0.40) ADORA2ATYMPHTTKMT2A
SCHEMBL5083648 0.81 DNPH1 (0.37) CDK1TMIGD3ADORA2AADORA1ADORA2B
SCHEMBL5080062 0.73 CDK1 (0.45) CDK1TMIGD3ADORA2AADORA1ADORA2B
SCHEMBL5086082 0.73 NPC1 (0.36) CDK1TMIGD3ADORA2AADORA1ADORA2B
SCHEMBL5086064 0.69 TAS1R3 (0.38) ADORA2AADORA1ADORA2BADORA3
SCHEMBL5083644 0.68 ADORA1 (0.41) ADORA2AADORA1ADORA2BADORA3

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
US-7388002-B2 Nucleosides, preparation thereof and use as inhibitors of RNA viral polymerases BIOCRYST PHARMACEUTICALS, INC. (US) 2008-06-17 US disclosed
US-20060122391-A1 Nucleosides, preparation thereof and use as inhibitors of RNA viral polymerases BIOCRYST PHARMACEUTICALS, INC. (US) 2006-06-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060122391-A1 Nucleosides, preparation thereof and use as inhibitors of RNA viral polymerases POLR2H, NSUN2, POLR2E CDK1 704/4885TMIGD3 4143/4885ADORA2A 1427/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.