SCHEMBL23488288

SCHEMBL23488288

COc1cc(C(=O)OC[C@H]2O[C@H](OC)[C@H](O)[C@@H](O)[C@@H]2O)cc(Cl)c1OCc1cnc(OC)c(Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
XDH P47989 2/20 0.44
TDP1 Q9NUW8 2/20 0.43
PTPN1 P18031 2/20 0.40
ERBB2 P04626 1/20 0.37
EPHA2 P29317 1/20 0.37
KDR P35968 1/20 0.37
EPHX2 P34913 2/20 0.36
TSHR P16473 1/20 0.34

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
SCHEMBL23488447 1.00 XDH (0.44) XDHTDP1PTPN1ERBB2EPHA2
SCHEMBL23488678 0.86 TDP1 (0.47) XDHTDP1PTPN1
SCHEMBL23488568 0.86 TDP1 (0.47) XDHTDP1PTPN1
SCHEMBL23488542 0.84 LGALS3 (0.38) PTPN1EPHX2
SCHEMBL23488709 0.84 LGALS8 (0.44) PTPN1
SCHEMBL23488601 0.83 TDP1 (0.44) XDHTDP1PTPN1ERBB2EPHA2
SCHEMBL23488536 0.83 TDP1 (0.44) XDHTDP1PTPN1ERBB2EPHA2
SCHEMBL23488654 0.81 CA2 (0.45)
SCHEMBL23488695 0.80 TDP1 (0.43) XDHTDP1ERBB2EPHA2KDR
SCHEMBL23488299 0.80 TDP1 (0.44) XDHTDP1

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-20210170033-A1 NOVEL CONJUGATES OF A PHARMACEUTICAL AGENT AND A MOIETY CAPABLE OF BINDING TO A GLUCOSE SENSING PROTEIN SANOFI (FR) 2021-06-10 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-20210170033-A1 NOVEL CONJUGATES OF A PHARMACEUTICAL AGENT AND A MOIETY CAPABLE OF BINDING TO A GLUCOSE SENSING PROTEIN GPR119, SLC2A8, SLC2A4 XDH 3028/4885TDP1 4093/4885PTPN1 2662/4885

“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.