SCHEMBL17372803

SCHEMBL17372803

[N-]=[N+]=Nc1cc[nH]n1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL4295351 0.72
SCHEMBL5206443 0.72
SCHEMBL21058060 0.68
SCHEMBL15516207 0.66 GABRA1 (0.38)
SCHEMBL28922069 0.65
SCHEMBL15349277 0.65
SCHEMBL30780093 0.65
SCHEMBL29088729 0.65
Naphthalene SCHEMBL11589769 0.64 CYP2A6 (0.36)
SCHEMBL751762 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109097025-B Preparation method of adjustable fluorescent nitrogen dots 中山大学 2021-07-27 CN claimed
US-12209072-B2 Cyclopentyl acids as LPA antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 2025-01-28 US disclosed
CN-112055710-B As LPA antagonists Cyclohexylacid pyrazole azine 百时美施贵宝公司 2025-01-28 CN disclosed
CN-112041029-B Cyclic compounds as LPA antagonists pyrazole hexyl acid 百时美施贵宝公司 2025-01-24 CN disclosed
CN-111699180-B Pyrazole N-linked carbamoyl cyclohexyl acid as LPA antagonist 百时美施贵宝公司 2024-11-29 CN disclosed
EP-3728216-B1 PYRAZOLE N-LINKED CARBAMOYL CYCLOHEXYL ACIDS AS LPA ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2023-09-06 EP disclosed
EP-3852746-B1 CYCLOPENTYL ACIDS AS LPA ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2023-03-29 EP disclosed
EP-3728222-B1 CYCLOHEXYL ACID PYRAZOLE AZINES AS LPA ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2023-03-29 EP disclosed
US-11384067-B2 Pyrazole n-linked carbamoyl cyclohexyl acids as LPA antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 2022-07-12 US disclosed
EP-3727589-B1 CYCLOHEXYL ACID PYRAZOLE AZOLES AS LPA ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2022-06-29 EP disclosed
EP-3727589-A1 CYCLOHEXYL ACID PYRAZOLE AZOLES AS LPA ANTAGONISTS Bristol-Myers Squibb Company (US) 2020-10-28 EP disclosed
EP-3728222-A1 CYCLOHEXYL ACID PYRAZOLE AZINES AS LPA ANTAGONISTS Bristol-Myers Squibb Company (US) 2020-10-28 EP disclosed
CN-111699180-A Pyrazole N-linked carbamoylcyclohexanoic acids as LPA antagonists 百时美施贵宝公司 2020-09-22 CN disclosed
WO-2020060915-A1 CYCLOPENTYL ACIDS AS LPA ANTAGONISTS BRISTOL-MYERS SQUIBB COMPANY (US) 2020-03-26 WO disclosed
US-10299478-B2 Pyrazolyltriazolylpyridines as pesticides BAYER ANIMAL HEALTH GMBH (DE) 2019-05-28 US disclosed
EP-3157913-B1 PYRAZOLYL TRIAZOLYL PYRIDINES AS PESTICIDE BAYER ANIMAL HEALTH GMBH (DE) 2019-04-17 EP disclosed
CN-107074813-A Pyrazolyl triazolyl pyridines as pesticides 拜耳动物保健有限责任公司 2017-08-18 CN disclosed
US-20170112129-A1 NOVEL PYRAZOLYLTRIAZOLYLPYRIDINES AS PESTICIDES ELANCO ANIMAL HEALTH GMBH (DE) 2017-04-27 US disclosed
EP-3157913-A1 PYRAZOLYL-TRIAZOLYL-PYRIDINES AS PEST-CONTROL AGENTS Bayer Animal Health GmbH (DE) 2017-04-26 EP disclosed
WO-2015193216-A1 PYRAZOLYL-TRIAZOLYL-PYRIDINES AS PEST-CONTROL AGENTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2015-12-23 WO disclosed