SCHEMBL4186934

SCHEMBL4186934

COc1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](OC(C)=O)[C@H]2OC(C)=O)cc1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LGALS8 O00214 3/20 0.56
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
TYR P14679 1/20 0.48
MEN1 O00255 1/20 0.48
TP53 P04637 1/20 0.48
CYP3A4 P08684 1/20 0.48
KMT2A Q03164 1/20 0.48
CYP2C9 P11712 1/20 0.48
SLC5A1 P13866 1/20 0.46
SLC5A2 P31639 1/20 0.46

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
SCHEMBL4186930 1.00 LGALS8 (0.56) LGALS8NPC1RAB9ATYRMEN1
SCHEMBL23121475 0.90 LGALS8 (0.50) LGALS8NPC1RAB9ATYRMEN1
SCHEMBL7998397 0.90 MEN1 (0.54) LGALS8MEN1TP53CYP3A4KMT2A
SCHEMBL9181428 0.85 ALDH1A1 (0.47) TYR
SCHEMBL9181422 0.85 ALDH1A1 (0.47) TYR
SCHEMBL13755879 0.84 CYP3A4 (0.54) MEN1TP53CYP3A4KMT2ACYP2C9
SCHEMBL30361411 0.82 TYR (0.65) TYR
SCHEMBL4189072 0.82 CYP3A4 (0.49) LGALS8MEN1TP53CYP3A4KMT2A
SCHEMBL13755884 0.81 CYP3A4 (0.63) MEN1TP53CYP3A4KMT2ACYP2C9
SCHEMBL12870233 0.81 CYP3A4 (0.63) MEN1TP53CYP3A4KMT2ACYP2C9

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-20090215710-A1 CARBOHYDRATE BASED TOLL-LIKE RECEPTOR (TLR) ANTAGONISTS RELIANCE LIFE SCIENCES PVT. LTD. (IN) 2009-08-27 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-20090215710-A1 CARBOHYDRATE BASED TOLL-LIKE RECEPTOR (TLR) ANTAGONISTS TLR4, TLR1, TLR2 LGALS8 134/4885NPC1 2638/4885RAB9A 4104/4885

“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.