SCHEMBL2534111

SCHEMBL2534111

C=CCO[C@H]1O[C@H](CO)[C@@H](O)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 2/20 0.56
▸ LGALS8 O00214 1/20 0.45
▸ BCHE P06276 1/20 0.43
▸ LGALS3 P17931 3/20 0.39
▸ PDE4D Q08499 1/20 0.39
▸ SLC2A1 P11166 1/20 0.39

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
SCHEMBL13224920 1.00 SLC6A2 (0.56) SLC6A2LGALS8BCHELGALS3PDE4D
SCHEMBL2536430 1.00 SLC6A2 (0.56) SLC6A2LGALS8BCHELGALS3PDE4D
SCHEMBL9791495 0.93 SLC6A2 (0.62) SLC6A2LGALS8BCHELGALS3PDE4D
SCHEMBL9791489 0.93 SLC6A2 (0.62) SLC6A2LGALS8BCHELGALS3PDE4D
SCHEMBL11513219 0.92 SLC6A2 (0.52) SLC6A2LGALS8BCHELGALS3
SCHEMBL181077 0.90 SLC6A2 (0.47) SLC6A2BCHE
SCHEMBL181126 0.90 SLC6A2 (0.47) SLC6A2BCHE
SCHEMBL181127 0.90 SLC6A2 (0.47) SLC6A2BCHE
SCHEMBL6929599 0.90 SLC6A2 (0.47) SLC6A2BCHE
SCHEMBL2172329 0.90 SLC6A2 (0.47) SLC6A2BCHE

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2388264-A1 COMPOUND RETAINED IN TUMOR Toyo Suisan Kaisha, Ltd. (JP) 2011-11-23 — — EP disclosed
US-20110254443-A1 PHASE AND FREQUENCY LOCKED MAGNETRON MUONS, INC. 2011-10-20 — — US disclosed
US-20100202971-A1 COMPOUND HAVING TUMOR-RESIDENT PROPERTY OHTA KEISUKE 2010-08-12 — — US disclosed
US-4987223-A INTERMEDIATES FOR GLYCOSIDE ENZYME SUBSTRATES CHOAY S.A. (FR) 1991-01-22 — — US disclosed
EP-0084999-A1 Process for the preparation of organic oligosaccharides, corresponding to fragments of natural muco-polysaccharides, oligosaccharides obtained and their biological applications D.R.O.P.I.C. (Société Civile) (FR) 1983-08-03 — — EP disclosed
EP-0082793-A1 Derivatives with a uronic acid structure, their preparation and their biological applications D.R.O.P.I.C. (Société Civile) (FR) 1983-06-29 — — 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-20100202971-A1 COMPOUND HAVING TUMOR-RESIDENT PROPERTY HRH3, HRH4, HNRNPH3 SLC6A2 2975/4885LGALS8 3075/4885BCHE 204/4885

“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.

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