SCHEMBL1109969

SCHEMBL1109969

[C]#CC(C)Cl

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
SCHEMBL2199 0.70
SCHEMBL1979005 0.70
SCHEMBL2556849 0.67
SCHEMBL7725 0.67
SCHEMBL11600321 0.64
SCHEMBL9152466 0.64
SCHEMBL835425 0.64
SCHEMBL967131 0.64
SCHEMBL7524186 0.64
SCHEMBL379983 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090042957-A1 Substituted Oxyarenes BAYER CROPSCIENCE AG (DE) 2009-02-12 US claimed
US-5942541-A PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1999-08-24 US claimed
US-5723646-A Substituted amino acid amide derivatives their preparation and use as fungicides BAYER AKTIENGESELLSCHAFT (DE) 1998-03-03 US claimed
US-11377415-B2 Method for converting N,N-dialkylamide compound into ester compound using complex of fourth-period transition metal as catalyst TAKASAGO INTERNATIONAL CORPORATION (JP) 2022-07-05 US disclosed
EP-3760607-A1 METHOD FOR CONVERTING N,N-DIALKYLAMIDE COMPOUND INTO ESTER COMPOUND USING COMPLEX OF FOURTH-PERIOD TRANSITION METAL AS CATALYST Takasago International Corporation (JP) 2021-01-06 EP disclosed
US-20200399200-A1 METHOD FOR CONVERTING N,N-DIALKYLAMIDE COMPOUND INTO ESTER COMPOUND USING COMPLEX OF FOURTH-PERIOD TRANSITION METAL AS CATALYST TAKASAGO INTERNATIONAL CORPORATION (JP) 2020-12-24 US disclosed
US-9758513-B2 Dihydrooxazine or oxazepine derivatives having BACE1 inhibitory activity SHIONOGI & CO., LTD. (JP) 2017-09-12 US disclosed
US-9648879-B2 Co-crystal and method for producing same NIPPON SODA CO., LTD. (JP) 2017-05-16 US disclosed
WO-2017061534-A1 DIHYDROTHIAZINE DERIVATIVES SHIONOGI & CO., LTD. (JP) 2017-04-13 WO disclosed
US-20170073337-A1 DIHYDROTHIAZINE AND DIHYDROOXAZINE DERIVATIVES HAVING BACE1 INHIBITORY ACTIVITY SHIONOGI & CO., LTD. (JP) 2017-03-16 US disclosed
EP-3129370-A1 DIHYDROTHIAZINE AND DIHYDROOXAZINE DERIVATIVES HAVING BACE1 INHIBITORY ACTIVITY Shionogi & Co., Ltd. (JP) 2017-02-15 EP disclosed
EP-2177519-A1 TETRAZOYLOXIME DERIVATIVE AND PLANT DISEASE CONTROL AGENT Nippon Soda Co., Ltd. (JP) 2010-04-21 EP disclosed
US-20090042957-A1 Substituted Oxyarenes BAYER CROPSCIENCE AG (DE) 2009-02-12 US disclosed
US-7153815-B2 Insecticide containing hydrazone derivative as the active ingredient and novel hydrazone derivative NIHON NOHYAKU CO., LTD. (JP) 2006-12-26 US disclosed
US-20050203149-A1 Insecticide containing hydrazone derivatives as the active ingredient and novel hydrazone derivates NIHON NOHYAKU CO., LTD (JP) 2005-09-15 US disclosed
EP-1470752-A1 INSECTICIDES CONTAINING HYDRAZONE DERIVATIVES AS THE ACTIVE INGREDIENT AND NOVEL HYDRAZONE DERIVATIVES Nihon Nohyaku Co., Ltd. (JP) 2004-10-27 EP disclosed
EP-0585745-B1 Direct positive silver halide photographic material and method for forming high contrast positive image using the same DAINIPPON INK & CHEMICALS (JP) 1999-03-24 EP disclosed
US-5362621-A Compound containing pyridine and pyridinium nucleus, reductone developer DAINIPPON INK AND CHEMICALS, INC. (JP) 1994-11-08 US disclosed
EP-0585745-A2 Direct positive silver halide photographic material and method for forming high contrast positive image using the same DAINIPPON INK AND CHEMICALS, INC. (JP) 1994-03-09 EP disclosed
US-4021387-A PARASITICIDES, ANAPHYLAXIS, BRONCHIAL ASTHMA PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 1977-05-03 US disclosed