SCHEMBL4950740

SCHEMBL4950740

O=C(O)C1=C(C(=O)O)NC=CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PYGM P11217 1/20 1.00

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
SCHEMBL4486368 0.77 PYGM (0.62) PYGM
SCHEMBL4696617 0.77 PYGM (0.62) PYGM
SCHEMBL10351643 0.72 PYGM (0.57) PYGM
SCHEMBL30162793 0.71 PYGM (0.55) PYGM
SCHEMBL890639 0.70 PYGM (0.52) PYGM
SCHEMBL7434274 0.69 PYGM (0.51) PYGM
SCHEMBL1649443 0.68 PYGM (0.52) PYGM
SCHEMBL20043145 0.64
SCHEMBL30622506 0.62 PYGM (0.45) PYGM
SCHEMBL13657660 0.61

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0538690-B1 Arylquinoline substituted 1,4-dihydropyridine dicarboxylic derivatives, process for their preparation and their use as drugs BAYER AG (DE) 1994-09-28 EP claimed
US-5262429-A CARDIOTONIC AGENTS BAYER AKTIENGESELLSCHAFT (DE) 1993-11-16 US claimed
EP-0172140-B1 PROCESS FOR THE PREPARATION OF PYRIDINE-2,3-DICARBOXYLIC-ACID DERIVATIVES AND 1-AMINO-1,2,3,4-TETRAHYDRO-PYRIDINE-2,3-DICARBOXYLIC ACID DERIVATIVES AND 2,4-DIHYDROPYRIDINE-2,3-DICARBOXYLIC-ACID DERIVATIVES CIBA-GEIGY AG (CH) 1989-09-06 EP claimed
US-4754033-A CLEAVAGE OF HYDRAZING GROUP, OXIDATION CIBA-GEIGY CORPORATION (US) 1988-06-28 US claimed
JP-1038068-A None JP disclosed
JP-7215938-A None JP disclosed
JP-4234847-A None JP disclosed
US-20080175800-A1 USE OF SPECIFIC MENTHYL 3-OXOCARBOXYLIC ACID ESTERS AS PHYSIOLOGICALLY ACTIVE COOLING SUBSTANCES SYMRISE GMBH & CO. KG (DE) 2008-07-24 US disclosed
EP-0588372-B1 Process for preparing pyridine-2,3-dicarboxylic acid compounds SUGAI CHEMICAL IND CO LTD (JP) 2002-10-02 EP disclosed
US-6140401-A COMPRISING SODIUM ALUMINOSILICATES, HYDROTALCITES AND CALCIUM-ALUMINIUM-HYDROXY-PHOSPHITES, AND AT LEAST ONE SOLID OR LIQUID ZINC SALT HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2000-10-31 US disclosed
US-5475111-A Process for the preparation of dihydropyridinecarboxylic acids BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1995-12-12 US disclosed
JP-H07215938-A 1,4-DIHYDROPYRIDINEDICARBOXYLIC ACID MONOESTERS AND THEIR PRODUCTION FUJISAWA PHARMACEUT CO LTD 1995-08-15 JP disclosed
EP-0274379-A2 Process for preparing pyridine-2,3-dicarboxylic acid compounds SUGAI CHEMICAL INDUSTRY CO., LTD. (JP) 1988-07-13 EP disclosed
US-4754033-A CLEAVAGE OF HYDRAZING GROUP, OXIDATION CIBA-GEIGY CORPORATION (US) 1988-06-28 US disclosed
US-4754033-A CLEAVAGE OF HYDRAZING GROUP, OXIDATION CIBA-GEIGY CORPORATION (US) 1988-06-28 US disclosed
US-4754033-A CLEAVAGE OF HYDRAZING GROUP, OXIDATION CIBA-GEIGY CORPORATION (US) 1988-06-28 US disclosed
US-4705786-A Novel oxadiazolyl-1,4-dihydropyridines useful as antihypertensive agents SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1987-11-10 US disclosed
EP-0177965-A2 Novel oxa- and thiadiazolyl derivatives and their use SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1986-04-16 EP disclosed
US-3932646-A CORONARY VASODILATORS, HYPOTENSIVE AGENTS FARBENFABRIKEN BAYER AG (DT) 1976-01-13 US disclosed
US-3932645-A CORONARY VASODILATORS, HYPOTENSIVE AGENTS FARBENFABRIKEN BAYER AG (DT) 1976-01-13 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-20080175800-A1 USE OF SPECIFIC MENTHYL 3-OXOCARBOXYLIC ACID ESTERS AS PHYSIOLOGICALLY ACTIVE COOLING SUBSTANCES ECI1, OTC, MDH2 PYGM 2136/4885

“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.