SCHEMBL23037276

SCHEMBL23037276

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

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK1 P06493 1/20 0.46
▸ CCNB1 P14635 1/20 0.46
▸ MGMT P16455 1/20 0.46
▸ CCNA2 P20248 1/20 0.46
▸ CDK2 P24941 1/20 0.46
▸ CCNA1 P78396 1/20 0.46
▸ NUDT1 P36639 3/20 0.39
▸ MAPT P10636 7/20 0.38
▸ ALDH1A1 P00352 6/20 0.38
▸ HTT P42858 2/20 0.38
▸ POLB P06746 4/20 0.38
▸ MEN1 O00255 7/20 0.36
▸ KMT2A Q03164 7/20 0.36
▸ LMNA P02545 6/20 0.36
▸ NPSR1 Q6W5P4 5/20 0.36
▸ TP53 P04637 3/20 0.36
▸ TSHR P16473 2/20 0.36
▸ CASP1 P29466 2/20 0.36
▸ CASP7 P55210 2/20 0.36
▸ MAPK1 P28482 2/20 0.36

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
SCHEMBL3850636 0.81 NUDT1 (0.38) CDK1CCNB1MGMTCCNA2CDK2
SCHEMBL23037259 0.81 NUDT1 (0.33) CDK1CCNB1MGMTCCNA2CDK2
SCHEMBL3854995 0.76 NUDT1 (0.33) CDK1CCNB1MGMTCCNA2CDK2
SCHEMBL2800474 0.76 NPC1 (0.57) NUDT1MAPTALDH1A1POLBLMNA
SCHEMBL3854998 0.73 CDK1 (0.33) CDK1CCNB1MGMTCCNA2CDK2
SCHEMBL6398516 0.73 THRB (0.44) NUDT1ALDH1A1POLBKMT2AMAPK1
SCHEMBL3853468 0.72 FGFR1 (0.30) —
SCHEMBL23037265 0.72 CDK1 (0.47) CDK1CCNB1MGMTCCNA2CDK2
SCHEMBL10398846 0.71 CDK1 (0.43) CDK1CCNB1CCNA2CDK2CCNA1
SCHEMBL16463790 0.71 CDK1 (0.43) CDK1CCNB1CCNA2CDK2CCNA1

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 CDK1 621/4885CCNB1 825/4885MGMT 1720/4885
US-20210079031-A1 NEW ANTIVIRAL ACYCLONUCLEOSIDE ANALOGUES TYMP, EIF2AK2, PNP CDK1 256/4885CCNB1 485/4885MGMT 1660/4885

“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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