SCHEMBL3661086

SCHEMBL3661086

Nc1cc(Cl)cc(N)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
SCHEMBL247619 0.85
SCHEMBL29838724 0.85
SCHEMBL29829702 0.81
SCHEMBL29844600 0.81
SCHEMBL17923105 0.81
SCHEMBL15542009 0.81
SCHEMBL2185366 0.81
SCHEMBL21355550 0.77 NOTUM (0.39)
SCHEMBL4279853 0.77 ADORA2A (0.41)
SCHEMBL10443700 0.77 CYP3A4 (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116376131-A Self-repairing natural rubber material and preparation method thereof 上海工程技术大学 2023-07-04 CN claimed
US-20230322803-A1 SUBSTITUTED OXOISOINDOLINE COMPOUNDS FOR THE TREATMENT OF CANCER BRISTOL MYERS SQUIBB CO (US) 2023-10-12 US disclosed
CN-116376131-A Self-repairing natural rubber material and preparation method thereof 上海工程技术大学 2023-07-04 CN disclosed
US-10981879-B2 Thioether triazolopyridine and triazolopyrimidine inhibitors of myeloperoxidase BRISTOL-MYERS SQUIBB COMPANY (US) 2021-04-20 US disclosed
US-10316035-B2 Triazolopyridine inhibitors of myeloperoxidase BRISTOL-MYERS SQUIBB COMPANY (US) 2019-06-11 US disclosed
US-20190031623-A1 THIOETHER TRIAZOLOPYRIDINE AND TRIAZOLOPYRIMIDINE INHIBITORS OF MYELOPEROXIDASE BRISTOL MYERS SQUIBB CO (US) 2019-01-31 US disclosed
US-20180244671-A1 TRIAZOLOPYRIDINE INHIBITORS OF MYELOPEROXIDASE BRISTOL-MEYERS SQUIBB COMPANY (US) 2018-08-30 US disclosed
EP-3191486-B1 THIOETHER TRIAZOLOPYRIDINE AND TRIAZOLOPYRMIDINE INHIBITORS OF MYELOPEROXIDASE BRISTOL MYERS SQUIBB CO (US) 2018-08-01 EP disclosed
US-9920075-B2 Triazolopyridine and triazolopyrimidine inhibitors of myeloperoxidase BRISTOL-MYERS SQUIBB COMPANY (US) 2018-03-20 US disclosed
US-20170247343-A1 THIOETHER TRIAZOLOPYRIDINE AND TRIAZOLOPYRIMIDINE INHIBITORS OF MYELOPEROXIDASE BRISTOL-MYERS SQUIBB COMPANY (US) 2017-08-31 US disclosed
US-5420214-A Process to prevent scale adhesion using condensation product of a diamino heterocyclic and a quinone SHIN-ETSU CHEMICAL CO., LTD. (JP) 1995-05-30 US disclosed
EP-0614915-A1 Polymer scale preventive agent Shin-Etsu Chemical Co., Ltd. (JP) 1994-09-14 EP disclosed
EP-0382588-B1 METHOD FOR THE REDUCTION OF A REFINING CATALYST BEFORE ITS USE EURECAT EUROPEENNE DE RETRAITEMENT DE CATALYSEURS (FR) 1993-03-24 EP disclosed
EP-0349358-B1 PROCESS FOR PRESULFIDING AND CONTROLLING THE ACTIVITY OF A HYDROCARBON TREATMENT CATALYST EURECAT EUROPEENNE DE RETRAITEMENT DE CATALYSEURS (FR) 1992-03-04 EP disclosed
US-5059731-A Selectively hydrogenating acetylenic and diolefinic hydrocarbons EUROPEANE DE RETRAITEMENT DE CATALYSEURS EURECAT (FR) 1991-10-22 US disclosed
US-4983559-A CATALYTIC REGENERATION EUROPEENE DE RETRAITEMENT DE CATALYSEURS EURECAT (FR) 1991-01-08 US disclosed
EP-0349358-A1 Process for presulfiding and controlling the activity of a hydrocarbon treatment catalyst EURECAT EUROPEENNE DE RETRAITEMENT DE CATALYSEURS (FR) 1990-01-03 EP disclosed
US-4076718-A 2,6-Pyridinediyl-bis-tetrazol-5-carboxamides AMERICAN HOME PRODUCTS CORPORATION (US) 1978-02-28 US disclosed
US-4038398-A PROPHYLACTIC TREATMENT FOR ALLERGY AND ANAPHYLACTIC REACTIONS ION THE UPJOHN COMPANY (US) 1977-07-26 US disclosed
US-3963660-A ANTI-ALLERGY THE UPJOHN COMPANY (US) 1976-06-15 US disclosed