SCHEMBL61840

SCHEMBL61840

O=[C]c1cccnc1

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
SCHEMBL3796332 0.79 CYP2A6 (0.67)
SCHEMBL31044654 0.76 CYP2A6 (0.52)
SCHEMBL2155209 0.76 CYP2A6 (0.52)
SCHEMBL5219678 0.76 CYP11B2 (0.67)
SCHEMBL28598621 0.76 CYP11B2 (0.52)
SCHEMBL443665 0.75
SCHEMBL9525696 0.75
SCHEMBL1468179 0.75
SCHEMBL9853210 0.75
SCHEMBL8516557 0.75

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

Appears in 11932 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4399212-A1 SUBSTITUTED 2,3-DIHYDRO[1,3]THIAZOLO[4,5-B]PYRIDINES, SALTS THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES Bayer Aktiengesellschaft (DE) 2024-07-17 EP claimed
EP-4396348-A2 HIGH MOLECULAR WEIGHT MODIFIED DSRNA COMPOSITIONS Nanosur LLC (US) 2024-07-10 EP claimed
CN-118302524-A High molecular weight modified dsRNA compositions 纳诺索尔公司 2024-07-05 CN claimed
CN-118164997-A Sesquiterpene lactone scaberol C thioether derivative, and preparation method and application thereof 沈阳药科大学 2024-06-11 CN claimed
CN-118164996-A Sesquiterpene lactone scaberol C selenoether derivative, preparation method and application thereof 沈阳药科大学 2024-06-11 CN claimed
CN-118159542-A Substituted 2, 3-dihydro [1,3] thiazolo [4,5-b ] pyridines, salts thereof and their use as herbicidal agents 拜耳公司 2024-06-07 CN claimed
CN-117624185-A LRRK2 inhibitor compound, pharmaceutical composition, preparation method and application thereof 长春金赛药业有限责任公司 2024-03-01 CN claimed
CN-117510500-A Preparation method of asperazepanones alkaloid and application of asperazepanones alkaloid as anti-inflammatory drug 中国海洋大学 2024-02-06 CN claimed
CN-117050043-A 3-phenyl dibenzofuran compound and preparation method and application thereof 中国海洋大学 2023-11-14 CN claimed
CN-116726010-A Application of macrolide derivative in preparation of medicines for inhibiting pro-inflammatory cytokine acting agents 中国海洋大学 2023-09-12 CN claimed
US-4053608-A 3-NITROPYRIDINE CARBOXAMIDES, POULTRY FEED SANKYO COMPANY LIMITED (JA) 1977-10-11 US claimed
US-4017624-A N-(ω-Amino)alkylaniline derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-04-12 US claimed
US-3983238-A Substituted pyridinol-containing compositions and methods for the treatment of coccidiosis SANKYO COMPANY LIMITED (JA) 1976-09-28 US claimed
US-3975532-A ANALGESIC ICI UNITED STATES INC. (US) 1976-08-17 US claimed
US-3969523-A Antiphlogistic pharmaceutical compositions containing a 1-(nicotinoyl or isonicotinoyl)-3-biphenylyl-alkanone-(2) BOEHRINGER INGELHEIM GMBH (DT) 1976-07-13 US claimed
US-3961066-A ANALGESICS, ANTITUSSIVES SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-06-01 US claimed
US-3957803-A CERTAIN TRANSIENT PRO-DRUG FORMS OF PHENYLBUTAZONE INTERX RESEARCH CORPORATION (US) 1976-05-18 US claimed
US-3953596-A 8-Oxa-3-azabicyclo(3.2.1)octane analgesic compositions and method of alleviating pain in animals ICI UNITED STATES INC. (US) 1976-04-27 US claimed
US-3932482-A CARDIOTONIC STERLING DRUG INC. (US) 1976-01-13 US claimed
US-3932429-A Novel azabicyclo octane derivative and process for preparing same TANABE SEIYAKU CO., LTD (JA) 1976-01-13 US claimed