SCHEMBL13239692

SCHEMBL13239692

CC[C@H]1O[C@@H](n2cnc3c(Oc4cccc5cccnc45)ncnc32)C(C)[C@H]1C

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DNPH1 O43598 2/20 0.44
SLC29A1 Q99808 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.38
KDM4E B2RXH2 1/20 0.37
ADORA1 P30542 2/20 0.36
TYMP P19971 1/20 0.35
AMD1 P17707 1/20 0.35
GAA P10253 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
SCHEMBL15165609 1.00 DNPH1 (0.44) DNPH1SLC29A1ALDH1A1MAPTKDM4E
SCHEMBL15165608 0.83 DNPH1 (0.39) DNPH1SLC29A1ALDH1A1MAPTKDM4E
SCHEMBL13239691 0.83 DNPH1 (0.39) DNPH1SLC29A1ALDH1A1MAPTKDM4E
SCHEMBL13265487 0.82 SLC29A1 (0.62) DNPH1SLC29A1ALDH1A1ADORA1
SCHEMBL13239677 0.77 SLC29A1 (0.44) SLC29A1ADORA1GAA
SCHEMBL15165601 0.77 SLC29A1 (0.44) SLC29A1ADORA1GAA
SCHEMBL13265435 0.75 ALDH1A1 (0.46) DNPH1SLC29A1ALDH1A1MAPT
SCHEMBL13239688 0.75 SLC29A1 (0.46) SLC29A1
SCHEMBL15165605 0.75 SLC29A1 (0.46) SLC29A1
SCHEMBL15165611 0.75 DNPH1 (0.40) DNPH1SLC29A1ADORA1GAA

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-20100179312-A1 CONVERTIBLE NUCLEOSIDE DERIVATIVES LAKSHMAN MAHESH K 2010-07-15 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-20100179312-A1 CONVERTIBLE NUCLEOSIDE DERIVATIVES PNP, NUDT1, NUDT14 DNPH1 121/4885SLC29A1 19/4885ALDH1A1 1657/4885

“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.