SCHEMBL6539016

SCHEMBL6539016

COC(=O)/C=C(\N)C(OC)OC

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.40
KEAP1 Q14145 1/20 0.40
NFE2L2 Q16236 1/20 0.40
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
GFPT1 Q06210 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
SCHEMBL11134387 1.00 HCAR2 (0.40) HCAR2KEAP1NFE2L2PDE4APDE4B
SCHEMBL6539020 1.00 HCAR2 (0.40) HCAR2KEAP1NFE2L2PDE4APDE4B
SCHEMBL11125923 0.81 HCAR2 (0.36) HCAR2KEAP1NFE2L2PDE4APDE4B
SCHEMBL10817869 0.79 NPSR1 (0.47) HCAR2
SCHEMBL10817860 0.79 NPSR1 (0.47) HCAR2
SCHEMBL831789 0.79 HCAR2 (0.42) HCAR2KEAP1NFE2L2PDE4APDE4B
SCHEMBL10967253 0.79 SLC1A3 (0.33) HCAR2
SCHEMBL10967248 0.79 SLC1A3 (0.33) HCAR2
SCHEMBL831788 0.79 HCAR2 (0.42) HCAR2KEAP1NFE2L2PDE4APDE4B
SCHEMBL8069973 0.76 HCAR2 (0.39) HCAR2KEAP1NFE2L2PDE4APDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250051345-A1 PYRIDINE-3-CARBOXYLATE COMPOUNDS AS CAV1.2 ACTIVATORS NOVARTIS AG (CH) 2025-02-13 US disclosed
EP-4448533-A1 <SUP2/>? <SUB2/>?V?PYRIDINE-3-CARBOXYLATE COMPOUNDS AS CA1.2 ACTIVATORS Novartis AG (CH) 2024-10-23 EP disclosed
CN-118510782-A As CaV1.2 Pyridine-3-carboxylic acid ester Compounds of activators 诺华股份有限公司 2024-08-16 CN disclosed
WO-2023111799-A1 PYRIDINE-3-CARBOXYLATE COMPOUNDS AS CaV1.2 ACTIVATORS NOVARTIS AG (CH) 2023-06-22 WO disclosed
US-20040067955-A1 Pyridazinone compound and pharmaceutical use thereof FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2004-04-08 US disclosed
WO-2004022540-A2 PYRIDAZINONE AND PYRIDONE DERIVATIVES AS ADENOSINE ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-03-18 WO disclosed
EP-0177965-B1 NOVEL OXA- AND THIADIAZOLYL DERIVATIVES AND THEIR USE SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1990-03-21 EP disclosed
US-4857515-A Certain antihypertensive 1,4-dihydro-6-methyl-5-phosphonic acid-4-aryl-3-carboxylic acid-2-cyano diesters NIPPON SHINYAKU CO., LTD. (JP) 1989-08-15 US disclosed
EP-0063747-B1 2-SUBSTITUTED OR UNSUBSTITUTED AMINOCARBONYLOXYALKYL-1,4-DIHYDROPYRIDINES BANYU PHARMACEUTICAL CO., LTD. (JP) 1987-12-09 EP 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-4579859-A HYPOTENSIVE AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-04-01 US disclosed
EP-0174131-A2 Dihydropyridines, processes and intermediates for their production, and pharmaceutical formulations containing them FISONS plc (GB) 1986-03-12 EP disclosed
EP-0127150-A2 2,6-Disubstituted-1,4-dihydropyridine derivative, process for the preparation of the same and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-12-05 EP disclosed
US-4404378-A HYPOTENSIVE AGENTS; VASODILATION BANYU PHARMACEUTICAL CO., LTD. (JP) 1983-09-13 US disclosed
EP-0063747-A1 2-Substituted or unsubstituted aminocarbonyloxyalkyl-1,4-dihydropyridines BANYU PHARMACEUTICAL CO., LTD. (JP) 1982-11-03 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 (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-20040067955-A1 Pyridazinone compound and pharmaceutical use thereof ADORA1, ADORA2A, P2RX5 HCAR2 1877/4885KEAP1 823/4885NFE2L2 2052/4885
US-20250051345-A1 PYRIDINE-3-CARBOXYLATE COMPOUNDS AS CAV1.2 ACTIVATORS CACNA1D, CACNA1S, CACNA1I HCAR2 1130/4885KEAP1 2913/4885NFE2L2 3413/4885

“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.