SCHEMBL22490853

SCHEMBL22490853

COc1c(C(=O)CO[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]2O)ccc(O)c1Cl

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
TNF P01375 1/20 0.36
IL6 P05231 1/20 0.36
SLC5A1 P13866 2/20 0.36
SLC5A2 P31639 1/20 0.36
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.35
APP P05067 1/20 0.35
SLC28A3 Q9HAS3 4/20 0.34
POLB P06746 1/20 0.34
ALDH1A1 P00352 2/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
CA13 Q8N1Q1 1/20 0.33

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
SCHEMBL22490910 0.78 LGALS8 (0.37) NPC1RAB9ASLC5A1SLC5A2LMNA
SCHEMBL22490896 0.76 SLC28A3 (0.34) SLC5A1SLC5A2SLC28A3POLBALDH1A1
SCHEMBL22490856 0.75 NPC1 (0.37) NPC1RAB9ATNFIL6SLC5A1
SCHEMBL25584038 0.68 ALDH1A1 (0.45) SLC5A1SLC5A2TSHRALDH1A1
SCHEMBL25584039 0.68 ALDH1A1 (0.45) SLC5A1SLC5A2TSHRALDH1A1
SCHEMBL25204142 0.68 ALDH1A1 (0.45) SLC5A1SLC5A2TSHRALDH1A1
SCHEMBL25266700 0.68 ALDH1A1 (0.45) SLC5A1SLC5A2TSHRALDH1A1
SCHEMBL30438255 0.68 ALDH1A1 (0.45) SLC5A1SLC5A2TSHRALDH1A1
SCHEMBL11026134 0.66 SLC5A2 (0.48) NPC1RAB9ASLC5A1SLC5A2
SCHEMBL16227512 0.65 SLC29A1 (0.43) APP

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 NPC1 1840/4885RAB9A 1043/4885TNF 4667/4885

“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.