SCHEMBL6972906

SCHEMBL6972906

COc1cc(Cl)n[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
SCHEMBL486686 0.83 LMNA (0.39)
SCHEMBL896562 0.74
SCHEMBL2116936 0.74
SCHEMBL3575455 0.73
SCHEMBL10617720 0.72 KDM4E (0.30)
SCHEMBL3381842 0.68 GAA (0.40)
SCHEMBL10617694 0.68 PKM (0.31)
SCHEMBL9481270 0.68
SCHEMBL2339978 0.65 ALDH1A1 (0.47)
SCHEMBL31051487 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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4889553-A Herbicides SCHERING AGROCHEMICALS (GB) 1989-12-26 US claimed
EP-0132230-B1 PROCESS FOR THE PREPARATION OF SULFONYL UREA CIBA-GEIGY AG (CH) 1988-10-05 EP claimed
EP-0246749-A2 Triazole herbicides AgrEvo UK Limited (GB) 1987-11-25 EP claimed
US-4656273-A Process for producing sulfonylureas CIBA-GEIGY CORPORATION (US) 1987-04-07 US claimed
EP-0132230-A2 Process for the preparation of sulfonyl urea CIBA-GEIGY AG (CH) 1985-01-23 EP claimed
CN-101903379-A Herbicidal compound based on N-azine group-N '-pyridyl sulfonylurea BAYER CROPSCIENCE AG 2010-12-01 CN disclosed
CN-1319949-C Chrysanthemacyl thiourea pyrimidine derivative with bioactivity, and its preparing method and pesticide composition UNIV SHANGHAI (CN) 2007-06-06 CN disclosed
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed
US-5965587-A PESTICIDES, FUNGICIDES BASF AKTIENGESELLSCHAFT (DE) 1999-10-12 US disclosed
WO-1993010086-A1 PROCESS FOR PREPARING N-(ARYLSULPHONYL)-CARBAMIDE ACID DERIVATES AND INTERMEDIATES USEFUL FOR CARRYING OUT THIS PROCESS MTA Központi Kémiai Kutató Intézete (HU) 1993-05-27 WO disclosed
US-4897108-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1990-01-30 US disclosed
US-4889553-A Herbicides SCHERING AGROCHEMICALS (GB) 1989-12-26 US disclosed
US-4769060-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-09-06 US disclosed
EP-0246749-A2 Triazole herbicides AgrEvo UK Limited (GB) 1987-11-25 EP disclosed
US-4661147-A PLANT GROWTH REGULATORS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1987-04-28 US disclosed