SCHEMBL108457

SCHEMBL108457

O=C(O)C(O)C(O)C(=O)ON1C(=O)CCC1=O

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
MGLL Q99685 2/20 0.36
NFKB1 P19838 1/20 0.35
CYP2C19 P33261 1/20 0.35
ALDH1A1 P00352 1/20 0.31
PKM P14618 1/20 0.31
PARL Q9H300 1/20 0.31

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
SCHEMBL108464 1.00 TSHR (0.39) TSHRMGLLNFKB1CYP2C19ALDH1A1
SCHEMBL20404645 0.92 MGLL (0.36) MGLLPARL
SCHEMBL111364 0.92 MGLL (0.36) MGLLPARL
SCHEMBL37884 0.92 MGLL (0.36) MGLLPARL
SCHEMBL23584357 0.81 MGLL (0.32) MGLL
SCHEMBL13286374 0.81 MGLL (0.32) MGLL
SCHEMBL13286350 0.81 MGLL (0.32) MGLL
SCHEMBL4003476 0.81 MGLL (0.33) MGLL
SCHEMBL4003479 0.81 MGLL (0.33) MGLL
SCHEMBL2573222 0.79 MGLL (0.36) MGLLPARL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200080122-A1 Cleavable Nucleotide Analogs and Uses Thereof PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2020-03-12 US claimed
CN-110420671-A A kind of agglutinin micro-array chip and preparation method thereof NANJING KERUIXIN BIO TECH CO LTD 2019-11-08 CN claimed
CN-102666879-B Templated nanometer conjugate NORTHWEST UNIVERSITY (US) 2016-02-24 CN claimed
CN-102666879-A Templated nanoconjugates UNIV NORTHWESTERN 2012-09-12 CN claimed
CN-101405301-A Conjugates comprising pharmacologically active compounds covalently linked to mucoadhesive polymers and methods of transmucosal administration of pharmacologically active compounds using the same KWANGJU INST SCI & TECH (KR) 2009-04-08 CN claimed
CN-101039965-A Sialic acid derivatives LIPOXEN TECHNOLOGIES LTD (GB) 2007-09-19 CN claimed
CN-87103784-A IMMUNOPOTATION 1987-12-09 CN claimed
US-20260077088-A1 SELF-DEGRADING ENZYME LOADED BIOLOGICALLY DERIVED PARTICLES CRANNMED LIMITED (IE) 2026-03-19 US disclosed
EP-4583839-A1 SELF-DEGRADING ENZYME LOADED BIOLOGICALLY DERIVED PARTICLES Crannmed Limited (IE) 2025-07-16 EP disclosed
WO-2025137256-A1 POLYOXAZOLINE-CARBOHYDRATE-LIPID CONJUGATES WU NIAN (US) 2025-06-26 WO disclosed
US-20250099480-A1 METHODS AND PHARMACEUTICAL COMPOSITIONS FOR TREATING CANDIDA AURIS IN BLOOD CORMEDIX INC (US) 2025-03-27 US disclosed
US-12016865-B2 Methods and pharmaceutical compositions for treating candida auris in blood CORMEDIX INC. (US) 2024-06-25 US disclosed
WO-2024052780-A1 SELF-DEGRADING ENZYME LOADED BIOLOGICALLY DERIVED PARTICLES CRANNMED LIMITED (IE) 2024-03-14 WO disclosed
US-5241012-A Nitrated, reduced to amine, diazotization to link with protein ; electrophilic substitution APPLIED IMMUNE SCIENCES, INC. (US) 1993-08-31 US disclosed
US-5045312-A Complexing BURROUGHS WELLCOME CO. (US) 1991-09-03 US disclosed
EP-0377649-A1 HALOGENATED SURFACE WITH REDUCED PROTEIN INTERACTION. HEWLETT PACKARD CO (US) 1990-07-18 EP disclosed
WO-1989012225-A1 HALOGENATED SURFACE WITH REDUCED PROTEIN INTERACTION HEWLETT-PACKARD COMPANY (US) 1989-12-14 WO disclosed
EP-0294059-A2 Activated and conjugated polyaryl substrates RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1988-12-07 EP disclosed
CN-87102945-A Pre-S gene coded peptide hepatilis B immunogens, vaccine, diagnostic agent and synthetic lipid vesicle carriers 1988-04-20 CN disclosed
CN-87103784-A IMMUNOPOTATION 1987-12-09 CN 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 (2 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-20200080122-A1 Cleavable Nucleotide Analogs and Uses Thereof TYMP, DUT, NT5C3B TSHR 2802/4885MGLL 4064/4885NFKB1 2847/4885
US-20260077088-A1 SELF-DEGRADING ENZYME LOADED BIOLOGICALLY DERIVED PARTICLES MMP2, PLG, PMM2 TSHR 1647/4885MGLL 607/4885NFKB1 4280/4885

“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.