SCHEMBL29564697

SCHEMBL29564697

NC(=O)c1ccc2nn(-c3cccnc3)cc2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 3/20 0.46
MKNK2 Q9HBH9 3/20 0.46
F7 P08709 1/20 0.45
F3 P13726 1/20 0.45
SARM1 Q6SZW1 1/20 0.45
SIRT2 Q8IXJ6 1/20 0.45
SIRT6 Q8N6T7 1/20 0.45
SIRT1 Q96EB6 1/20 0.45
SIRT3 Q9NTG7 1/20 0.45
SIRT5 Q9NXA8 1/20 0.45
SIRT4 Q9Y6E7 1/20 0.45
ESR2 Q92731 1/20 0.45
CHEK2 O96017 2/20 0.41
ADORA3 P0DMS8 3/20 0.40
IRAK4 Q9NWZ3 1/20 0.39
CCNA2 P20248 1/20 0.39
CDK2 P24941 1/20 0.39
CCNA1 P78396 1/20 0.39
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.39

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
SCHEMBL19328774 1.00 MKNK1 (0.46) MKNK1MKNK2F7F3SARM1
SCHEMBL17802507 0.88 ESR2 (0.49) MKNK1MKNK2ESR2ADORA3ALDH1A1
SCHEMBL31457215 0.88 ESR2 (0.49) MKNK1MKNK2ESR2ADORA3ALDH1A1
SCHEMBL20548985 0.87 ESR2 (0.45) ESR2ADORA3ALDH1A1HPGDTLR8
SCHEMBL30872907 0.87 ESR2 (0.45) ESR2ADORA3ALDH1A1HPGDTLR8
SCHEMBL17802466 0.84 CYP19A1 (0.53) ESR2ADORA3KDM4EALDH1A1POLB
SCHEMBL30872906 0.84 CYP19A1 (0.53) ESR2ADORA3KDM4EALDH1A1POLB
SCHEMBL31457231 0.84 ESR2 (0.42) ESR2ADORA3KDM4EALDH1A1POLB
SCHEMBL31375424 0.82 MAPK1 (0.44) ESR2ADORA3ALDH1A1HPGDTLR8
SCHEMBL20548980 0.82 ADORA3 (0.46) ESR2ADORA3KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116916751-A Insect and acarina pest control 先正达农作物保护股份公司 2023-10-20 CN claimed
CN-114845551-B Enzyme enhanced root uptake of agrochemically active compounds 巴斯夫欧洲公司 2025-04-29 CN disclosed
CN-119894889-A Pyrazolo pesticidal compounds 巴斯夫欧洲公司 2025-04-25 CN disclosed
CN-119546584-A Bicyclic compounds and their use as pest control agents PI工业有限公司 2025-02-28 CN disclosed
CN-117956984-A Novel microparticles containing active substances 巴斯夫欧洲公司 2024-04-30 CN disclosed
CN-117794908-A (3-quinolinyl) -quinazolines 巴斯夫欧洲公司 2024-03-29 CN disclosed
CN-117794907-A (3-pyridinyl) -quinazolines 巴斯夫欧洲公司 2024-03-29 CN disclosed
CN-116916751-A Insect and acarina pest control 先正达农作物保护股份公司 2023-10-20 CN disclosed
EP-4081037-A1 ENZYME ENHANCED ROOT UPTAKE OF AGROCHEMICAL ACTIVE COMPOUND BASF SE (DE) 2022-11-02 EP disclosed
CN-115005215-A Mixtures and compositions comprising a paenibacillus strain or fusaricidin and a chemical pesticide 巴斯夫欧洲公司 2022-09-06 CN disclosed
CN-109068645-B Mixtures and compositions comprising a paenibacillus strain or fusaricidin and a chemical pesticide 巴斯夫欧洲公司 2022-07-08 CN disclosed
CN-111801014-B Fungicidal compositions of cloroxen 巴斯夫农业公司 2022-05-27 CN disclosed