SCHEMBL168676

SCHEMBL168676

C1=CC2=CCC=CN2C=C1

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
SCHEMBL6174797 1.00
SCHEMBL27831840 0.98
SCHEMBL5853356 0.83
Isothiazole SCHEMBL3663008 0.80
SCHEMBL4552677 0.68
SCHEMBL2355100 0.68
SCHEMBL2722292 0.68
SCHEMBL4690174 0.67
SCHEMBL21500439 0.66
SCHEMBL2994409 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024052871-A1 NOVEL RUTHENIUM COMPLEXES, METHOD OF THEIR SYNTHESIS, INTERMEDIATE COMPOUNDS USED IN THIS METHOD, METHOD OF THEIR SYNTHESIS AND USE OF NOVEL RUTHENIUM COMPLEXES IN OLEFIN METATHESIS REACTIONS UNIWERSYTET WARSZAWSKI (PL) 2024-03-14 WO claimed
US-11613649-B2 Thermally-rearranged polymer blends for gas separation membranes BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2023-03-28 US claimed
US-20210095122-A1 THERMALLY-REARRANGED POLYMER BLENDS FOR GAS SEPARATION MEMBRANES UNITED STATES DEPARTMENT OF ENERGY 2021-04-01 US claimed
CN-105198884-B Pentacyclic indole quinolizine that the G1/G0 phases block, its synthesis, antitumor activity and application 首都医科大学 2017-08-01 CN claimed
US-7286279-B2 Microencapsulation processes and compositions for electrophoretic displays SIPIX IMAGING, INC. (US) 2007-10-23 US claimed
EP-1648921-A2 LIBRARIES CONTAINING HETEROCYCLIC ORGANIC MOLECULES PREPARED THROUGH INTRAMOLECULAR FORMATION OF N-ACYLIMINIUM IONS Carlsberg A/S (DK) 2006-04-26 EP claimed
WO-2004113362-A2 LIBRARIES CONTAINING HETEROCYCLIC ORGANIC MOLECULES PREPARED THROUGH INTRAMOLECULAR FORMATION OF N-ACYLIMINIUM IONS CARLSBERG A/S (DK) 2004-12-29 WO claimed
US-20040201567-A1 Novel microencapsulation processes and compositions for electrophoretic displays E INK CORPORATION 2004-10-14 US claimed
WO-2004012001-A1 NOVEL MICROENCAPSULATION PROCESSES AND COMPOSITIONS FOR ELECTROPHORETIC DISPLAYS SIPIX IMAGING, INC. (US) 2004-02-05 WO claimed
EP-0299533-B1 HIGH POTENCY SWEETENING AGENTS THE NUTRASWEET COMPANY (a Delaware corporation) (US) 1993-04-07 EP claimed
JP-55072189-A None JP disclosed
CN-118339165-A Antibody-drug conjugates and methods of use thereof R.P.谢勒技术有限责任公司 2024-07-12 CN disclosed
CN-118284436-A Methods of using antibody-drug conjugates R.P.谢勒技术有限责任公司 2024-07-02 CN disclosed
CN-118119644-A Antibodies with humanized framework regions R.P.谢勒技术有限责任公司 2024-05-31 CN disclosed
CN-118103137-A Process for preparing surfactants by copolymerization of epoxides and CO2 using a mixture of macrocyclic bimetallic catalysts and double metal cyanide catalysts 伊科尼克技术有限公司 2024-05-28 CN disclosed
US-4526969-A Trifluoromethyl substituted perfluoro quinolizines THE GREEN CROSS CORPORATION (JP) 1985-07-02 US disclosed
EP-0107201-A2 Phenyl-substituted tricyclic antibacterial agents RIKER LABORATORIES, INCORPORATED (US) 1984-05-02 EP disclosed
US-4443447-A Phenyl-substituted tricyclic antibacterial agents RIKER LABORATORIES, INC. (US) 1984-04-17 US disclosed
US-4230710-A Amide derivatives of 2-substituted anilino-hexahydrobenzo[a]quinolizines, and methods of treating hypertension employing them MILES LABORATORIES, INC. (US) 1980-10-28 US disclosed
JP-S5572189-A TRANSS22SUBSTITUTED AMIDOOHEXAHYDROBENZO*A*QUINOLIZINES MILES LAB 1980-05-30 JP disclosed