SCHEMBL1800935

SCHEMBL1800935

C[C](O)c1ccccc1

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
SCHEMBL38015 0.79 CES1 (0.52)
SCHEMBL10877617 0.79 CES2 (0.52)
SCHEMBL6567 0.79
SCHEMBL3281774 0.79 CES2 (0.52)
SCHEMBL3902058 0.79 ESR1 (0.56)
SCHEMBL11844374 0.79 ESR1 (0.56)
SCHEMBL1035354 0.79 ESR1 (0.56)
SCHEMBL23278527 0.76 ESR1 (0.61)
SCHEMBL21811153 0.76 CES2 (0.50)
SCHEMBL28658039 0.76 CES2 (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3625219-A1 PROCESS FOR PREPARING SUBSTITUTED IMIDAZOLYLCARBOXYAMIDES Bayer Aktiengesellschaft (DE) 2020-03-25 EP claimed
CN-102482731-B Method for recovering metals from aqueous solutions CYTEC TECH CORP 2015-06-10 CN claimed
EP-2091945-B1 NOVEL INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2014-01-15 EP claimed
US-7705050-B2 Amides, useful in the inhibition of IL-8-induced chemotaxis of neutrophils DOMPÉ FARMACEUTICI S.P.A. (IT) 2010-04-27 US claimed
EP-1255726-B1 (R)-2-ARYL-PROPIONAMIDES, USEFUL IN THE INHIBITION OF IL-8 INDUCED CHEMIOTAXIS OF NEUTROPHILS DOMPE PHA R MA SPA RES & MFG (IT) 2009-11-11 EP claimed
WO-2009131692-A1 SUBSTRATES FOR DELIVERY OF PHYSIOLOGICALLY ACTIVE AGENTS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2009-10-29 WO claimed
US-7521476-B2 Aminoacetonitrile derivatives suitable for controlling parasites NOVARTIS AG (CH) 2009-04-21 US claimed
US-7446219-B2 N-acylaminoacetonitrile derivatives and their use for controlling parasites NOVARTIS ANIMAL HEALTH US INC. (US) 2008-11-04 US claimed
US-20080194693-A1 Aminoacetonitrile Derivatives and Their Use for Controlling Parasites on Warm-Blooded Animals NOVARTIS AG (CH) 2008-08-14 US claimed
EP-1509221-B1 N-ACYLAMINOACETONITRILE DERIVATIVES AND THEIR USE FOR CONTROLLING PARASITES NOVARTIS AG (CH) 2008-07-09 EP claimed
US-6376548-B1 FUNGICIDES; HERBICIDES; INSECTICIDES ROHM AND HAAS COMPANY 2002-04-23 US claimed
WO-2001058852-A2 (R)-2-ARYL-PROPIONAMIDES, USEFUL IN THE INHIBITION OF IL-8-INDUCED CHEMIOTAXIS OF NEUTROPHILS Dompé S.p.A. (IT) 2001-08-16 WO claimed
EP-0853626-A1 SUBSTITUTED PHOSPHINIC COMPOUNDS AND THEIR USE AS PHARMACEUTICALS Novartis AG (CH) 1998-07-22 EP claimed
WO-1997009335-A1 SUBSTITUTED PHOSPHINIC COMPOUNDS AND THEIR USE AS PHARMACEUTICALS NOVARTIS AG (CH) 1997-03-13 WO claimed
EP-0113570-B1 5-(AMINO OR SUBSTITUTED AMINO) IMIDAZOLES MERCK & CO. INC. (US) 1987-02-25 EP claimed
EP-0113570-A1 5-(Amino or substituted amino) imidazoles MERCK & CO. INC. (US) 1984-07-18 EP claimed
EP-0037861-A1 Salts of alkylenebisdithiocarbamic acid derivatives, processes for their preparation, fungicidal compositions containing them and methods of combating fungi TOKYO ORGANIC CHEMICAL INDUSTRIES, LTD. (JP) 1981-10-21 EP claimed
US-4255152-A USING A DISPERSE DYE, WATER, AND AN ADDUCT OF ETHYLENE, PROPYLENE, OR STYRENE OXIDE AND A CYCLIC-SUBSTITUTED PHENOL; LEVELLING CIBA-GEIGY CORPORATION (US) 1981-03-10 US claimed
US-4127495-A BENZYLHYDROXYETHYL CELLULOSE OR PHENYLHYDROXYETHYL HYDROXYETHYL CELLULOSE AS ANTI-REDEPOSITION ADDITIVES HERCULES INCORPORATED (US) 1978-11-28 US claimed
US-4065319-A HYDRAULIC CEMENT, HYDROXYETHYL CELLULOSE WATER RETENTION AID ION HERCULES INCORPORATED (US) 1977-12-27 US claimed