SCHEMBL23488409

SCHEMBL23488409

C=CCO[C@@H]1O[C@H](COC(=O)c2cc(Cl)c(OCc3ccccc3)c(OC)c2)[C@@H](O)[C@H](O)[C@H]1O

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
XDH P47989 2/20 0.45
TDP1 Q9NUW8 2/20 0.43
KDM4E B2RXH2 1/20 0.41
TYMP P19971 1/20 0.39
ADCYAP1R1 P41586 1/20 0.38
PTPN1 P18031 1/20 0.38
EPHX2 P34913 2/20 0.38
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPK1 P28482 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 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
SCHEMBL23488568 0.89 TDP1 (0.47) XDHTDP1KDM4ETYMPADCYAP1R1
SCHEMBL23488678 0.89 TDP1 (0.47) XDHTDP1KDM4ETYMPADCYAP1R1
SCHEMBL23488685 0.87 XDH (0.51) XDHTDP1KDM4ETYMPMEN1
SCHEMBL23488129 0.85 KDM4E (0.46) XDHTDP1KDM4EADCYAP1R1MEN1
SCHEMBL23488693 0.85 KDM4E (0.46) XDHTDP1KDM4EADCYAP1R1MEN1
SCHEMBL23488175 0.83 TDP1 (0.44) XDHTDP1KDM4ETYMP
SCHEMBL23488525 0.83 TDP1 (0.44) XDHTDP1KDM4ETYMP
SCHEMBL23488299 0.83 TDP1 (0.44) XDHTDP1KDM4ETYMP
SCHEMBL23488607 0.81 XDH (0.48) XDHTDP1TYMPPTPN1ALDH1A1
SCHEMBL23488254 0.80 CHRNB2 (0.45) XDHTDP1TYMP

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 4093/4885KDM4E 4293/4885

“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.