SCHEMBL22490910

SCHEMBL22490910

COc1c(C(=O)CO[C@@H]2[C@@H](O)[C@@H](O)[C@@H](CO)O[C@@H]2O)cc(Cl)c(OCc2ccccc2)c1Cl

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LGALS8 O00214 1/20 0.37
PDE4D Q08499 1/20 0.36
SLC6A2 P23975 1/20 0.35
SLC5A2 P31639 5/20 0.35
LGALS3 P17931 1/20 0.35
SLC5A1 P13866 1/20 0.35
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
SLC29A1 Q99808 1/20 0.34
HRAS P01112 1/20 0.34
LMNA P02545 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 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
SCHEMBL22490909 0.83 LGALS8 (0.42) LGALS8PDE4DSLC5A2LGALS3KDM4E
Hydrochloric Acid SCHEMBL22490928 0.81 ADORA1 (0.34) SLC5A2SLC5A1
SCHEMBL23488625 0.81 LGALS3 (0.47) LGALS8SLC6A2SLC5A2LGALS3
SCHEMBL23488453 0.81 LGALS3 (0.47) LGALS8SLC6A2SLC5A2LGALS3
SCHEMBL23488706 0.78 CA2 (0.47) LGALS8LGALS3
SCHEMBL23488312 0.78 CA2 (0.47) LGALS8LGALS3
SCHEMBL22490853 0.78 NPC1 (0.39) SLC5A2SLC5A1ALDH1A1LMNANPC1
SCHEMBL22490858 0.75 PARP10 (0.47) SLC5A2SLC5A1ALDH1A1NPC1RAB9A
SCHEMBL22490929 0.75 PARP10 (0.47) SLC5A2SLC5A1ALDH1A1NPC1RAB9A
SCHEMBL22490921 0.75 PARP10 (0.47) SLC5A2SLC5A1ALDH1A1NPC1RAB9A

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-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
EP-3717463-A1 NOVEL CONJUGATES OF A PHARMACEUTICAL AGENT AND A MOIETY CAPABLE OF BINDING TO A GLUCOSE SENSING PROTEIN Sanofi (FR) 2020-10-07 EP 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 LGALS8 61/4885PDE4D 1147/4885SLC6A2 1655/4885

“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.