SCHEMBL399620

SCHEMBL399620

C[C]1C=CC(C)=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
SCHEMBL7088191 0.63
SCHEMBL1921780 0.57
SCHEMBL895221 0.51
P-Xylene SCHEMBL33600 0.47
SCHEMBL15484301 0.47
SCHEMBL7009257 0.45
SCHEMBL11277497 0.40
SCHEMBL1468768 0.40
P-Xylene SCHEMBL771 0.38
SCHEMBL8619911 0.38

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117413629-A Hole transport material, precursor for synthesizing hole transport material, and method for producing hole transport material 日本精化株式会社 2024-01-16 CN claimed
WO-2023115167-A1 COMPOUNDS Psylo Pty Ltd (AU) 2023-06-29 WO claimed
CN-115521289-A Pyridine derivative and preparation method thereof 江苏恒瑞医药股份有限公司 2022-12-27 CN claimed
EP-4013903-A1 COMPOSITIONS AND METHODS USING SAME FOR NON-CONFORMAL DEPOSITION OF SILICON-CONTAINING FILMS Versum Materials US, LLC (US) 2022-06-22 EP claimed
CN-114365265-A Compositions for non-conformal deposition of silicon-containing films and methods of using the same 弗萨姆材料美国有限责任公司 2022-04-15 CN claimed
WO-2021050368-A1 COMPOSITIONS AND METHODS USING SAME FOR NON-CONFORMAL DEPOSITION OF SILICON-CONTAINING FILMS VERSUM MATERIALS US, LLC (US) 2021-03-18 WO claimed
US-9409938-B2 Tungsten oxo alkylidene complexes for Zselective olefin metathesis MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2016-08-09 US claimed
US-9399648-B2 Isothiazolopyridinones useful for the treatment of (inter alia) cystic fibrosis VERTEX PHARMACEUTICALS INCORPORATED (US) 2016-07-26 US claimed
US-9315604-B2 Metathesis catalysts and methods thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2016-04-19 US claimed
EP-2187884-B1 ISOTHIAZOLOPYRIDINONES USEFUL FOR THE TREATMENT OF (INTER ALIA) CYSTIC FIBROSIS VERTEX PHARMA (US) 2016-03-30 EP claimed
US-6174922-B1 FOR POTENTIATING GLUTAMATE RECEPTOR FUNCTION IN WARM BLOODED MAMMAL ELI LILLY AND COMPANY 2001-01-16 US claimed
US-5985912-A COUMARONE COMPOUNDS AS BACTERICIDES PFIZER INC. (US) 1999-11-16 US claimed
WO-1999043285-A2 SULPHONAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 1999-09-02 WO claimed
EP-0937708-A2 sulphonamide derivatives ELI LILLY AND COMPANY (US) 1999-08-25 EP claimed
US-5624951-A 4-hydroxy coumarin derivatives with antibacterial activity PFIZER INC. (US) 1997-04-29 US claimed
EP-0658158-A1 4-HYDROXY COUMARIN DERIVATIVES WITH ANTIBACTERIAL ACTIVITY PFIZER INC. (US) 1995-06-21 EP claimed
WO-1994005649-A1 4-HYDROXY COUMARIN DERIVATIVES WITH ANTIBACTERIAL ACTIVITY PFIZER INC. (US) 1994-03-17 WO claimed
US-5118704-A Treating disorders of central nervous, cardiovascular and endocrine systems WHITBY RESEARCH, INC. (US) 1992-06-02 US claimed
US-4914093-A CARDIOVASCULAR DISORDERS SANKYO COMPANY LIMITED (JP) 1990-04-03 US claimed
EP-0178189-A2 Pyridazinone derivatives, their preparation and use SANKYO COMPANY LIMITED (JP) 1986-04-16 EP claimed