SCHEMBL3492399

SCHEMBL3492399

O=C[C@H](OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H](O)[C@H](O)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PGD P52209 1/20 0.36
PDE4A P27815 1/20 0.32
PGK1 P00558 1/20 0.31
PGK2 P07205 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
SCHEMBL3431354 0.88 PGD (0.39) PGDPDE4APGK1PGK2
SCHEMBL1016010 0.79 BTN3A1 (0.33)
SCHEMBL11305111 0.79 BTN3A1 (0.33)
SCHEMBL9698100 0.79 BTN3A1 (0.33)
SCHEMBL29512271 0.79 BTN3A1 (0.33)
Glucuronic Acid SCHEMBL27891138 0.77 MPI (0.39) PGDPDE4APGK1PGK2
Glucuronic Acid SCHEMBL3696739 0.77 MPI (0.39) PGDPDE4APGK1PGK2
SCHEMBL5165444 0.77 LMNA (0.37) PDE4A
SCHEMBL536484 0.77 LMNA (0.37) PDE4A
SCHEMBL4082207 0.77 LMNA (0.37) PDE4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118995702-A Double-stranded ribonucleic acid for inhibiting UGT1A1 gene expression, and modification, conjugate and application thereof 北京福元医药股份有限公司 2024-11-22 CN disclosed
US-11891655-B2 Probe for selectively characterizing enzymes involved in xenobiotic metabolism and method of making and using the same BATTELLE MEMORIAL INSTITUTE (US) 2024-02-06 US disclosed
EP-3755339-B1 3-BETA-(4-METHOXYBENZYLOXY)PREGN-5-EN-20-ONE FOR USE IN THE TREATMENT OF CANNABINOIDS-RELATED DISORDERS AELIS FARMA (FR) 2024-01-03 EP disclosed
EP-3692014-B1 PROBE FOR SELECTIVELY CHARACTERIZING ENZYMES INVOLVED IN XENOBIOTIC METABOLISM AND METHOD OF MAKING AND USING THE SAME BATTELLE MEMORIAL INSTITUTE (US) 2023-11-22 EP disclosed
US-20230226076-A1 3beta-(4-methoxybenzyloxy)pregn-5-en-20-one for use in the treatment of Cannabinoids-Related Disorders INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2023-07-20 US disclosed
US-11345950-B2 Probe for selectively characterizing enzymes involved in xenobiotic metabolism and method of making and using the same BATTELLE MEMORIAL INSTITUTE (US) 2022-05-31 US disclosed
EP-3691653-A1 SULFATED OLIGOSACCHARIDES HAVING ANTI-INFLAMMATORY ACTIVITY The University Of North Carolina At Chapel Hill (US) 2020-08-12 EP disclosed
EP-3692014-A1 PROBE FOR SELECTIVELY CHARACTERIZING ENZYMES INVOLVED IN XENOBIOTIC METABOLISM AND METHOD OF MAKING AND USING THE SAME Battelle Memorial Institute (US) 2020-08-12 EP disclosed
CN-109689048-A Oxytocin antagonist dosing regimen to promote embryo implantation and prevent miscarriage 奥布赛瓦股份公司 2019-04-26 CN disclosed
WO-2019069297-A2 PROBE FOR SELECTIVELY CHARACTERIZING ENZYMES INVOLVED IN XENOBIOTIC METABOLISM AND METHOD OF MAKING AND USING THE SAME KILLINGER, BYRAN J. (US) 2019-04-11 WO disclosed
WO-2009051502-A1 METHODS OF MAINTAINING OR INCREASING GROWTH OR COGNITIVE DEVELOPMENT HODGKINSON STEVEN CHARLES (NZ) 2009-04-23 WO disclosed
WO-2008092987-A1 A METHOD FOR IMPROVING THE PHARMACOKINETICS OF DRUGS METABOLIZED BY UGT2B10 ORION CORPORATION (FI) 2008-08-07 WO disclosed
EP-1893222-A2 ANTI-HYPERCHOLESTEROLEMIC COMPOUNDS Merck & Co., Inc. (US) 2008-03-05 EP disclosed
CN-1304577-C Cotton glucuronate transferase and coded gene thereof UNIV TSINGHUA (CN) 2007-03-14 CN disclosed
WO-2006138163-A2 ANTI-HYPERCHOLESTEROLEMIC COMPOUNDS MERCK & CO., INC. (US) 2006-12-28 WO disclosed
CN-1673374-A Cotton glucuronate transferase and coded gene thereof UNIV TSINGHUA (CN) 2005-09-28 CN disclosed
US-20040110954-A1 Methods of synthesizing phenol-contining compounds SMITHKLINE BEECHAM CORPORATION 2004-06-10 US disclosed
EP-1383488-A2 METHODS OF SYNTHESIZING PHENOL-CONTAINING COMPOUNDS SmithKline Beecham Corporation (US) 2004-01-28 EP disclosed
WO-2002079122-A2 METHODS OF SYNTHESIZING PHENOL-CONTAINING COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2002-10-10 WO disclosed
WO-1996040165-A1 METHODS OF REDUCING TOXICITY OF CHEMOTHERAPEUTIC AND ANTIVIRAL AGENTS WITH ACYLATED PYRIMIDINE NUCLEOSIDES PRO-NEURON, INC. (US) 1996-12-19 WO 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 (4 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-20040110954-A1 Methods of synthesizing phenol-contining compounds COMT, BPHL, PNMT PGD 266/4885PDE4A 929/4885PGK1 1156/4885
US-11345950-B2 Probe for selectively characterizing enzymes involved in xenobiotic metabolism and method of making and using the same CYP2E1, CYP1A1, CYP7A1 PGD 589/4885PDE4A 1018/4885PGK1 1171/4885
US-11891655-B2 Probe for selectively characterizing enzymes involved in xenobiotic metabolism and method of making and using the same CYP2E1, CYP1A1, CYP7A1 PGD 589/4885PDE4A 1018/4885PGK1 1171/4885
US-20230226076-A1 3beta-(4-methoxybenzyloxy)pregn-5-en-20-one for use in the treatment of Cannabinoids-Related Disorders CNR1, CNR2, CYP17A1 PGD 614/4885PDE4A 1556/4885PGK1 1371/4885

“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.