SCHEMBL23488449

SCHEMBL23488449

CO[C@@H]1O[C@H](COC(=O)c2ccc(I)c(OCc3ccccc3)c2)[C@@H](O)[C@H](O)[C@H]1O

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
XDH P47989 2/20 0.47
TYMP P19971 1/20 0.46
LGALS8 O00214 1/20 0.43
TDP1 Q9NUW8 2/20 0.43
NPC1 O15118 1/20 0.41
HPGD P15428 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
SMPD1 P17405 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
SYNJ2 O15056 3/20 0.38

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
SCHEMBL23488114 0.90 NPC1 (0.54) XDHTYMPTDP1NPC1HPGD
SCHEMBL23488164 0.90 TDP1 (0.52) XDHTYMPLGALS8TDP1NPC1
SCHEMBL23488630 0.90 XDH (0.48) XDHTYMPLGALS8TDP1NPC1
SCHEMBL23488679 0.89 XDH (0.47) XDHTYMPLGALS8TDP1NPC1
SCHEMBL23488711 0.85 TDP1 (0.49) XDHTYMPTDP1NPC1HPGD
SCHEMBL23488543 0.84 TYMP (0.46) XDHTYMPLGALS8TDP1NPC1
SCHEMBL23488668 0.84 CHRNB2 (0.51) XDHTYMPLGALS8TDP1SYNJ2
SCHEMBL23488128 0.84 CHRNB2 (0.51) XDHTYMPLGALS8TDP1SYNJ2
SCHEMBL23488262 0.84 CHRNB2 (0.51) XDHTYMPLGALS8TDP1SYNJ2
SCHEMBL23488300 0.84 TYMP (0.45) XDHTYMPLGALS8TDP1NPC1

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 3028/4885TYMP 2235/4885LGALS8 61/4885

“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.