SCHEMBL2742891

SCHEMBL2742891

CC(=O)NC1C(O)CC(C)(C(=O)O)OC1C(O)C(O)CO

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NANP Q8TBE9 3/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ NEU2 Q9Y3R4 3/20 0.47
▸ NEU4 Q8WWR8 2/20 0.47
▸ NEU3 Q9UQ49 2/20 0.47
▸ NEU1 Q99519 1/20 0.47
▸ SELL P14151 1/20 0.43
▸ SELP P16109 1/20 0.43
▸ MAG P20916 2/20 0.42
▸ SIGLEC7 Q9Y286 1/20 0.42

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
SCHEMBL20306037 1.00 NANP (0.54) NANPL3MBTL1NEU2NEU4NEU3
SCHEMBL23635227 1.00 NANP (0.54) NANPL3MBTL1NEU2NEU4NEU3
SCHEMBL13895438 1.00 NANP (0.54) NANPL3MBTL1NEU2NEU4NEU3
SCHEMBL13895451 1.00 NANP (0.54) NANPL3MBTL1NEU2NEU4NEU3
SCHEMBL23640238 1.00 NANP (0.54) NANPL3MBTL1NEU2NEU4NEU3
SCHEMBL13896479 0.91 L3MBTL1 (0.47) NANPL3MBTL1NEU2NEU4NEU3
SCHEMBL23640153 0.89 L3MBTL1 (0.46) NANPL3MBTL1NEU2NEU4NEU3
SCHEMBL14275077 0.88 NANP (0.53) NANPNEU4NEU3NEU1
SCHEMBL15147281 0.88 NANP (0.55) NANPL3MBTL1SELLSELPMAG
SCHEMBL12109014 0.88 NANP (0.53) NANPNEU4NEU3NEU1

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230210875-A1 LIPOSOMAL COMPOSITION FOR USE IN A METHOD OF TREATING PARKINSON'S DISEASE INNOMEDICA HOLDING AG (CH) 2023-07-06 — — US disclosed
US-20170321245-A1 Flash and Glow 1,2-Dioxetanes Life Technologies Corporation 2017-11-09 — — US disclosed
US-20160361332-A1 HETEROBIFUNCTIONAL PAN-SELECTIN INHIBITORS GLYCOMIMETICS INC (US) 2016-12-15 — — US disclosed
US-20160361332-A1 HETEROBIFUNCTIONAL PAN-SELECTIN INHIBITORS GLYCOMIMETICS INC (US) 2016-12-15 — — US disclosed
EP-2590958-B1 IN SITU CHEMILUMINESCENT SUBSTRATES AND ASSAYS LIFE TECHNOLOGIES CORP (US) 2015-08-26 — — EP disclosed
US-20140178303-A1 HETEROBIFUNCTIONAL PAN-SELECTIN INHIBITORS GLYCOMIMETICS, INC. (US) 2014-06-26 — — US disclosed
US-20140178303-A1 HETEROBIFUNCTIONAL PAN-SELECTIN INHIBITORS GLYCOMIMETICS, INC. (US) 2014-06-26 — — US disclosed
US-20140154675-A1 Flash and Glow 1,2-Dioxetanes Life Technologies Corporation (US) 2014-06-05 — — US disclosed
US-RE44778-E1 Heterobifunctional pan-selectin inhibitors GLYCOMIMETICS, INC. (US) 2014-02-25 — — US disclosed
US-RE44778-E1 Heterobifunctional pan-selectin inhibitors GLYCOMIMETICS, INC. (US) 2014-02-25 — — US disclosed
US-7989601-B2 Heterobifunctional pan-selectin inhibitors GLYCOMIMETICS, INC. (US) 2011-08-02 — — US disclosed
US-20100204170-A1 HETEROBIFUNCTIONAL PAN-SELECTIN INHIBITORS GLYCOMIMETICS, INC. (US) 2010-08-12 — — US disclosed
US-20100204170-A1 HETEROBIFUNCTIONAL PAN-SELECTIN INHIBITORS GLYCOMIMETICS, INC. (US) 2010-08-12 — — US disclosed
US-7728117-B2 Heterobifunctional pan-selectin inhibitors GLYCOMIMETICS, INC. (US) 2010-06-01 — — US disclosed
US-7728117-B2 Heterobifunctional pan-selectin inhibitors GLYCOMIMETICS, INC. (US) 2010-06-01 — — US disclosed
US-20090036386-A1 Heterobifunctional compounds for selectin inhibition GLYCOMIMETICS, INC (US) 2009-02-05 — — US disclosed
US-20090036386-A1 Heterobifunctional compounds for selectin inhibition GLYCOMIMETICS, INC (US) 2009-02-05 — — US disclosed
US-20070105755-A1 One pot desialylation and glycopegylation of therapeutic peptides NEOSE TECHNOLOGIES, INC. (US) 2007-05-10 — — US disclosed
US-20070054870-A1 glycomimetics; selectin binding modulators for use in treatment ofinflammatory, autoimmune, infection, cancer, shock, thrombosis, wounds, burns, reperfusion injury, blood, leukocyte-mediated lung injury, spinal cord damage, digestive tract mucous membrane disorders, osteoporosis, arthritis and asthma GLYCOMIMETICS, INC. (US) 2007-03-08 — — US disclosed
US-20070054870-A1 glycomimetics; selectin binding modulators for use in treatment ofinflammatory, autoimmune, infection, cancer, shock, thrombosis, wounds, burns, reperfusion injury, blood, leukocyte-mediated lung injury, spinal cord damage, digestive tract mucous membrane disorders, osteoporosis, arthritis and asthma GLYCOMIMETICS, INC. (US) 2007-03-08 — — 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 (8 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-20170321245-A1 Flash and Glow 1,2-Dioxetanes GLO1, DDX41, GDA NANP 1918/4885L3MBTL1 3591/4885NEU2 3593/4885
US-20090036386-A1 Heterobifunctional compounds for selectin inhibition SELE, SELL, BSG NANP 999/4885L3MBTL1 2197/4885NEU2 29/4885
US-20160361332-A1 HETEROBIFUNCTIONAL PAN-SELECTIN INHIBITORS SELE, SELP, BSG NANP 776/4885L3MBTL1 2309/4885NEU2 24/4885
US-20070054870-A1 glycomimetics; selectin binding modulators for use in treatment ofinflammatory, autoimmune, infection, cancer, shock, thrombosis, wounds, burns, reperfusion injury, blood, leukocyte-mediated lung injury, spinal cord damage, digestive tract mucous membrane disorders, osteoporosis, arthritis and asthma BSG, SELE, SELL NANP 3180/4885L3MBTL1 550/4885NEU2 483/4885
US-20070105755-A1 One pot desialylation and glycopegylation of therapeutic peptides UGGT1, PTMS, GALNT1 NANP 832/4885L3MBTL1 1265/4885NEU2 49/4885
US-20100204170-A1 HETEROBIFUNCTIONAL PAN-SELECTIN INHIBITORS SELE, SELP, BSG NANP 776/4885L3MBTL1 2309/4885NEU2 24/4885
US-20140178303-A1 HETEROBIFUNCTIONAL PAN-SELECTIN INHIBITORS SELE, SELP, BSG NANP 776/4885L3MBTL1 2309/4885NEU2 24/4885
US-20230210875-A1 LIPOSOMAL COMPOSITION FOR USE IN A METHOD OF TREATING PARKINSON'S DISEASE GBA1, GALC, SMPD3 NANP 381/4885L3MBTL1 2530/4885NEU2 21/4885

“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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