SCHEMBL2094399

SCHEMBL2094399

CNC(=CC(=O)O)NC

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
SCHEMBL10562763 0.73
SCHEMBL337169 0.73
SCHEMBL19657152 0.73
SCHEMBL28858723 0.71 KDM4E (0.39)
SCHEMBL12680133 0.69 KDM4E (0.32)
SCHEMBL5176644 0.69 HTT (0.43)
SCHEMBL12120877 0.69 HTT (0.43)
SCHEMBL2639006 0.69 KDM4E (0.37)
SCHEMBL15255473 0.69 HTT (0.43)
Fumaric Acid SCHEMBL9689356 0.65 TSHR (0.60)

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
JP-4751557-B2 2011-08-17 JP claimed
EP-1278717-B1 ONE-POT SYNTHESIS OF ALKYL 3-CYCLOPROPYLAMINO-2- 2,4-DIBROMO-3-(DIFLUOROMETHOXY)BENZOYL|-2-PROPENOATE AS A USEFUL INTERMEDIATE FOR ANTIBACTERIAL QUINOLONE MEDICAMENTS RANBAXY LAB LTD (IN) 2007-06-06 EP claimed
EP-1278717-A4 ONE-POT SYNTHESIS OF ALKYL 3-CYCLOPROPYLAMINO-2- 2,4-DIBROMO-3-(DIFLUOROMETHOXY)BENZOYL]-2-PROPENOATE AS A USEFUL INTERMEDIATE FOR ANTIBACTERIAL QUINOLONE MEDICAMENTS RANBAXY LAB LTD (IN) 2005-06-08 EP claimed
US-20040267019-A1 ONE-POT SYNTHESIS OF ALKYL 3-CYCLOPROPYLAMINO -2-[2,4-DIBROMO-3-(DIFLUROMETHOXY) BENZOYL]-2-PROPENOATE AS A USEFUL INTERMEDIATE FOR ANTIBACTERIAL QUINOLONE MEDICAMENTS TOYAMA CHEMICAL COMPANY, LIMITED (JP) 2004-12-30 US claimed
US-6835848-B1 Reacting 2,4-dibromo-3-(difluoromethoxy)benzoic acid with a halogenating agent to get a corresponding acid chloride, then reacting with a 3-(dialkylamino)acrylic acid alkyl ester and then cyclopropylamine RANBAXY LABORATORIES LIMITED (IN) 2004-12-28 US claimed
EP-1278717-A1 ONE-POT SYNTHESIS OF ALKYL 3-CYCLOPROPYLAMINO-2- 2,4-DIBROMO-3-(DIFLUOROMETHOXY)BENZOYL]-2-PROPENOATE AS A USEFUL INTERMEDIATE FOR ANTIBACTERIAL QUINOLONE MEDICAMENTS Ranbaxy Laboratories Limited (IN) 2003-01-29 EP claimed
WO-2001066512-A1 ONE-POT SYNTHESIS OF ALKYL 3-CYCLOPROPYLAMINO-2-[2,4-DIBROMO-3-(DIFLUOROMETHOXY)BENZOYL]-2-PROPENOATE AS A USEFUL INTERMEDIATE FOR ANTIBACTERIAL QUINOLONE MEDICAMENTS RANBAXY LABORATORIES LIMITED (IN) 2001-09-13 WO claimed
US-8163769-B2 1,8-naphthyridine derivatives ABBOTT LABORATORIES (US) 2012-04-24 US disclosed
EP-1636190-A1 STABLE CRYSTAL OF 4-OXOQUINOLINE COMPOUND Japan Tobacco, Inc. (JP) 2006-03-22 EP disclosed
EP-1631570-A1 NAPHTHYRIDINE DERIVATIVES AS ANTIBACTERIAL AGENTS Abbott Laboratories (US) 2006-03-08 EP disclosed
WO-2005113508-A1 STABLE CRYSTAL OF 4-OXOQUINOLINE COMPOUND JAPAN TOBACCO INC. (JP) 2005-12-01 WO disclosed
US-6818654-B2 1,2,3,4-TETRAHYDROQUINOLINE- OR 1,2,3,4-TETRAHYDRO-1,8-NAPHTHYRIDINE-3-CARBOXYLATE DERIVATIVES; TREATING INFECTIONS IN FISH OR MAMMALS ABBOTT LABORATORIES 2004-11-16 US disclosed
WO-2004083207-A1 NAPHTHYRIDINE DERIVATIVES AS ANTIBACTERIAL AGENTS ABBOTT LABORATORIES (US) 2004-09-30 WO disclosed
US-20040072817-A1 Antibacterial compounds ABBVIE INC. 2004-04-15 US disclosed
US-20030232818-A1 Antibacterial compounds ABBVIE INC. 2003-12-18 US disclosed