SCHEMBL23037259

SCHEMBL23037259

C=C(COC(C)=O)COc1cc(N)nc(N)n1

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ NUDT1 P36639 2/20 0.33
▸ MGMT P16455 3/20 0.33
▸ CDK1 P06493 2/20 0.33
▸ CCNB1 P14635 2/20 0.33
▸ CCNA2 P20248 2/20 0.33
▸ CDK2 P24941 2/20 0.33
▸ CCNA1 P78396 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ ADORA2A P29274 1/20 0.32
▸ ALDH1A1 P00352 3/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ GAA P10253 1/20 0.30
▸ NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL23037271 0.88 SMN1; SMN2 (0.40) NUDT1MGMTCDK1CCNB1CCNA2
SCHEMBL23037276 0.81 CDK1 (0.46) NUDT1MGMTCDK1CCNB1CCNA2
SCHEMBL23037754 0.80 NUDT1 (0.39) NUDT1CDK1CDK2
SCHEMBL3854995 0.80 NUDT1 (0.33) NUDT1MGMTCDK1CCNB1CCNA2
SCHEMBL3850636 0.79 NUDT1 (0.38) NUDT1MGMTCDK1CCNB1CCNA2
SCHEMBL3854998 0.76 CDK1 (0.33) NUDT1MGMTCDK1CCNB1CCNA2
SCHEMBL3853468 0.76 FGFR1 (0.30) —
SCHEMBL13715070 0.73 CDK1 (0.31) MGMTCDK1CCNB1CCNA2CDK2
SCHEMBL6004165 0.73 NUDT1 (0.33) NUDT1
SCHEMBL8612369 0.69 ALDH1A1 (0.48) ALDH1A1RAB9AHSD17B10GAA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11603380-B2 Antiviral acyclonucleoside analogues for use in treating a viral infection CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2023-03-14 — — US disclosed
US-20210079031-A1 NEW ANTIVIRAL ACYCLONUCLEOSIDE ANALOGUES NEOVIRTECH (FR) 2021-03-18 — — US disclosed
US-20210079031-A1 NEW ANTIVIRAL ACYCLONUCLEOSIDE ANALOGUES NEOVIRTECH (FR) 2021-03-18 — — US disclosed
EP-3784680-A1 NEW ANTIVIRAL ACYCLONUCLEOSIDE ANALOGUES Centre national de la recherche scientifique (FR) 2021-03-03 — — EP 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 (2 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-11603380-B2 Antiviral acyclonucleoside analogues for use in treating a viral infection TYMP, EIF2AK2, ENTPD5 NUDT1 22/4885MGMT 1720/4885CDK1 621/4885
US-20210079031-A1 NEW ANTIVIRAL ACYCLONUCLEOSIDE ANALOGUES TYMP, EIF2AK2, PNP NUDT1 27/4885MGMT 1660/4885CDK1 256/4885

“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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