SCHEMBL6696098

SCHEMBL6696098

COc1ccc(OCCOCn2cnc3nc(N)[nH]c(=O)c32)cc1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PNP P00491 5/20 0.45
HBB P68871 2/20 0.45
USP2 O75604 1/20 0.45
TSHR P16473 1/20 0.45
EDNRA P25101 1/20 0.45
HTR2A P28223 1/20 0.45
RECQL P46063 1/20 0.45
BLM P54132 1/20 0.45
HSD17B10 Q99714 1/20 0.45
XDH P47989 1/20 0.44
TYMS P04818 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
HPRT1 P00492 3/20 0.41
MAPK1 P28482 1/20 0.41
POLG P54098 1/20 0.40
PDE3A Q14432 2/20 0.40
NSD3 Q9BZ95 1/20 0.40

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
Hydrochloric Acid SCHEMBL7819451 0.81 TYMS (0.56) PNPXDHTYMSMEN1KMT2A
SCHEMBL6703317 0.80 PNP (0.51) PNPHBBUSP2TSHREDNRA
SCHEMBL6691912 0.80 PNP (0.67) PNPHBBUSP2TSHREDNRA
SCHEMBL6691792 0.76 NSD3 (0.52) XDHKMT2ARXFP1NSD3
SCHEMBL48416 0.74 ADORA2A (0.45) PNPHBBUSP2TSHREDNRA
SCHEMBL4592790 0.73 ADORA2A (0.47) PNPHBBUSP2TSHREDNRA
SCHEMBL29286377 0.73 TK1 (0.46) PNPHBBUSP2TSHREDNRA
SCHEMBL28712711 0.71 PNP (0.42) PNPHBBUSP2TSHREDNRA
SCHEMBL8842615 0.71 PNP (0.71) PNPHBBUSP2TSHREDNRA
SCHEMBL27710751 0.71 ADORA2A (0.52) MEN1KMT2A

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-6825348-B2 Antiviral compounds ACADEMIA SINICA (TW) 2004-11-30 US disclosed
US-20040002475-A1 Dna genome ACADEMIA SINICA (TW) 2004-01-01 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-20040002475-A1 Dna genome DNA2, OGG1, UNG PNP 36/4885HBB 1140/4885USP2 2435/4885

“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.