SCHEMBL2679155

SCHEMBL2679155

OCC1CCCN1n1cnc2c(O)ncnc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK1 P06493 4/20 0.33
▸ CCNB1 P14635 2/20 0.33
▸ CCNE1 P24864 2/20 0.33
▸ CDK2 P24941 2/20 0.33
▸ ADORA2A P29274 3/20 0.33
▸ ADORA3 P0DMS8 2/20 0.33
▸ ADORA1 P30542 2/20 0.33
▸ TSHR P16473 2/20 0.33
▸ PMP22 Q01453 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ ADORA2B P29275 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ SIGMAR1 Q99720 1/20 0.33
▸ SLC29A1 Q99808 1/20 0.33
▸ RXFP1 Q9HBX9 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ NFKB1 P19838 1/20 0.33
▸ HIF1A Q16665 1/20 0.33

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
SCHEMBL7987866 0.73 ADORA2A (0.35) ADORA2AADORA1ADORA2B
SCHEMBL1573051 0.68 AHCY (0.38) ADORA2AADORA3ADORA2BSLC29A1HIF1A
SCHEMBL4250330 0.68 AHCY (0.38) ADORA2AADORA3ADORA2BSLC29A1HIF1A
SCHEMBL6567336 0.64 ADORA3 (0.36) ADORA2AADORA3ADORA1ADORA2BSLC29A1
SCHEMBL6467183 0.64 ADORA2A (0.68) ADORA2AADORA3ADORA1ADORA2BMEN1
SCHEMBL10394463 0.64 ADCY5 (0.55) ADORA2AADORA3ADORA1ADORA2B
Didanosine SCHEMBL1769151 0.63 ALDH1A1 (0.61) HIF1ATDP1
SCHEMBL9114924 0.63 ADORA2A (0.38) ADORA2AADORA3ADORA1ADORA2B
Didanosine SCHEMBL29387997 0.63 ALDH1A1 (0.61) HIF1ATDP1
SCHEMBL9114922 0.63 ADORA2A (0.38) ADORA2AADORA3ADORA1ADORA2B

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-8173662-B2 Fused pyrimidines as inhibitors of nucleoside phosphorylases and nucleosidases INDUSTRIAL RESEARCH LIMITED (NZ) 2012-05-08 — — US disclosed
US-20090239885-A1 Inhibitors of nucleoside phoshorylases and nucleosidases BIOCRYST PHARMACEUTICALS, INC. 2009-09-24 — — 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-20090239885-A1 Inhibitors of nucleoside phoshorylases and nucleosidases PNP, MTAP, TYMP CDK1 929/4885CCNB1 1961/4885CCNE1 2559/4885

“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.

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