SCHEMBL9502453

SCHEMBL9502453

CC(=O)n1ccnc1C

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
SCHEMBL309967 0.83 FDPS (0.39)
SCHEMBL1165059 0.83 FDPS (0.39)
SCHEMBL298299 0.81
SCHEMBL11425272 0.79
SCHEMBL446875 0.79
SCHEMBL5691412 0.79 FDPS (0.34)
Hydrochloric Acid SCHEMBL16433303 0.77 PARP1 (0.42)
SCHEMBL26806860 0.77
SCHEMBL26806858 0.77
SCHEMBL1666896 0.77 NOTUM (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3956156-A PEROXY COMPOUND, 1A OR 2A CITRATE, ACTIVATOR COLGATE-PALMOLIVE COMPANY (US) 1976-05-11 US claimed
US-20230365561-A1 BETA-LACTAMASE INHIBITORS AND THEIR PREPARATION NINGXIA ACADEMY OF AGRICULTURE AND FORESTRY SCIENCES (CN) 2023-11-16 US disclosed
CN-113789316-A Phytases, nucleic acids encoding them and methods of making and using them 巴斯夫酶有限责任公司 2021-12-14 CN disclosed
CN-106222185-B Glucanases, nucleic acids encoding them and methods of making and using them 维莱尼姆公司 2021-12-03 CN disclosed
CN-104450754-B Phytases, nucleic acids encoding them and methods of making and using them 巴斯夫酶有限责任公司 2021-10-01 CN disclosed
US-8552054-B2 Anticancer agents, viricides, psychological disorders LUITPOLD PHARMACEUTICALS, INC. (US) 2013-10-08 US disclosed
US-20100273116-A1 SILVER HALIDE PHOTOSENSITIVE MATERIAL FUJIFILM CORPORATION (JP) 2010-10-28 US disclosed
US-7816398-B2 Fatty alcohol drug conjugates LUITPOLD PHARMACEUTICALS, INC. (US) 2010-10-19 US disclosed
CN-1370163-A Imidazo [1,2-A] pyridine and pyrazolo [2,3-a] pyridine derivatives ASTRAZENECA AB (SE) 2002-09-18 CN disclosed
EP-0332075-B1 PROCESS FOR THE PREPARATION OF ACYLATED IMIDAZOLES BASF Aktiengesellschaft (DE) 1993-06-02 EP disclosed
EP-0332075-A1 Process for the preparation of acylated imidazoles BASF Aktiengesellschaft (DE) 1989-09-13 EP disclosed
US-4590299-A 2-guanidino-4-heteroarylthiazoles PFIZER INC. (US) 1986-05-20 US disclosed
US-4510313-A 2-Guanidino-4-heteroarylthiazoles PFIZER INC. (US) 1985-04-09 US disclosed
EP-0050458-B1 2-GUANIDINO-4-HETEROARYLTHIAZOLES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM PFIZER INC. (US) 1985-01-02 EP disclosed
EP-0116205-A1 4(5)-Acetyl-2-methylimidazole process PFIZER INC. (US) 1984-08-22 EP disclosed
US-4452987-A Haloacetyl imidazoles PFIZER INC. (US) 1984-06-05 US disclosed
US-4374843-A 2-Guanidino-4-heteroarylthiazoles PFIZER INC. (US) 1983-02-22 US disclosed
EP-0050458-A2 2-Guanidino-4-heteroarylthiazoles and pharmaceutical compositions containing them PFIZER INC. (US) 1982-04-28 EP disclosed
US-3956156-A PEROXY COMPOUND, 1A OR 2A CITRATE, ACTIVATOR COLGATE-PALMOLIVE COMPANY (US) 1976-05-11 US disclosed