SCHEMBL6489591

SCHEMBL6489591

CCN(C(=O)O)C(=O)CC#N

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 4/20 0.39
HTT P42858 1/20 0.31
HSD17B10 Q99714 1/20 0.31
DPP4 P27487 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
SCHEMBL28504677 0.81 MCL1 (0.44) MCL1DPP4
SCHEMBL6219908 0.78 MEN1 (0.38) MCL1HTTHSD17B10
SCHEMBL5079020 0.76 MCL1 (0.52) MCL1
SCHEMBL1405183 0.75 LMNA (0.48) MCL1HSD17B10DPP4
SCHEMBL4943847 0.75 LMNA (0.48) MCL1HSD17B10DPP4
SCHEMBL5759921 0.74 NPC1 (0.35) HSD17B10
SCHEMBL1070893 0.74 MCL1 (0.38) MCL1
SCHEMBL1070889 0.74 MCL1 (0.48) MCL1
SCHEMBL9653268 0.73
Hydrochloric Acid SCHEMBL5796983 0.73 LMNA (0.46) MCL1HSD17B10DPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022184177-A1 AROMATIC COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF 甫康(上海)健康科技有限责任公司 2022-09-09 WO disclosed
EP-3066095-A1 SUBSTITUTED 1,2,4-TRIAZINE-3,5-DIONES AND THE USE THEREOF AS CHYMASE INHIBITORS Bayer Pharma Aktiengesellschaft (DE) 2016-09-14 EP disclosed
WO-2015067650-A1 SUBSTITUTED 1,2,4-TRIAZINE-3,5-DIONES AND THE USE THEREOF AS CHYMASE INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-05-14 WO disclosed
US-6951857-B2 Interleukins; cytokines; for treating eosinophil-dependent inflammatory disease/bronchial asthma FREYNE EDDY JEAN EDGARD 2005-10-04 US disclosed
US-5830893-A Treatment of equine protozoan myeloencephalitis using triazinediones MORTAR & PESTLE VETERINARY PHARMACY, INC. (US) 1998-11-03 US disclosed
US-4631278-A Anti-protozoal α-aryl-4-(4,5-dihydro-3,5-dioxo-1,2,4-triazin-2(3H)-yl)-benzeneacetonitrile derivatives, pharmaceutical compositions, and method of use therefor JANSSEN PHARMACEUTICA N.V. (BE) 1986-12-23 US disclosed
EP-0029719-B1 VULCANIZABLE RUBBER COMPOSITIONS INHIBITED FROM PREMATURE VULCANIZATION BY METHYLENE THIOETHERS, AND NOVEL METHYLENE THIOETHERS MONSANTO COMPANY (US) 1983-02-16 EP disclosed
US-4342705-A CONTAINING CARBONYL OR CYANO FUNCTIONAL GROUPS, USEFUL AS VULCANIZATION INHIBITORS MONSANTO COMPANY (US) 1982-08-03 US disclosed
EP-0029719-A1 Vulcanizable rubber compositions inhibited from premature vulcanization by methylene thioethers, and novel methylene thioethers MONSANTO COMPANY (US) 1981-06-03 EP disclosed
US-4271050-A Vulcanizable rubber compositions inhibited from premature vulcanization by methylene thioethers MONSANTO COMPANY (US) 1981-06-02 US disclosed