SCHEMBL8555048

SCHEMBL8555048

CC(=O)NCCCCCCC1CC[N]C1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.50
MAPK1 P28482 1/20 0.50
HIF1A Q16665 1/20 0.50
PAOX Q6QHF9 3/20 0.43
ADRA1A P35348 1/20 0.42
NAMPT P43490 1/20 0.35
SIGMAR1 Q99720 1/20 0.34
NAAA Q02083 1/20 0.33
EPHX1 P07099 5/20 0.33
EPHX2 P34913 2/20 0.33
PRCP P42785 1/20 0.33
ACACB O00763 1/20 0.32
ACACA Q13085 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL5624126 0.83 KDM4E (0.47) KDM4EMAPK1HIF1APAOXADRA1A
SCHEMBL23471393 0.81 KDM4E (0.64) KDM4EMAPK1HIF1APAOXADRA1A
SCHEMBL23471410 0.79 KDM4E (0.60) KDM4EMAPK1HIF1APAOXADRA1A
SCHEMBL7518035 0.77 ACHE (0.55) EPHX1EPHX2
SCHEMBL24115530 0.77 SIGMAR1 (0.59) KDM4EMAPK1HIF1APAOXADRA1A
SCHEMBL4887 0.76 CACNA1H (0.38) KDM4EMAPK1HIF1AEPHX1
SCHEMBL7511951 0.76 ACHE (0.52) EPHX2
SCHEMBL19731592 0.75 SIGMAR1 (0.56) KDM4EMAPK1HIF1APAOXADRA1A
SCHEMBL7511898 0.74 ALDH1A1 (0.43) SIGMAR1EPHX1
SCHEMBL7510428 0.74 ALDH1A1 (0.43) SIGMAR1EPHX1

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5811576-A 1-CARBOXY-2-LOWERALKYL-3,4,6-TRI(HALO)BENZENES; GRAMPOSITIVE AND-NEGATIVE BACTERIA; INFECTIONS; STERILIZATION OF MEDICAL EQUIPMENT OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1998-09-22 US disclosed
US-5723648-A Intermediates for anti-microbial benzoheterocyclic compounds OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1998-03-03 US disclosed
EP-0823413-A2 Benzoheterocyclic compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1998-02-11 EP disclosed
US-5591744-A 1,4-DIHYDRO-4-OXOQUINOLINE-3-CARBOXYLATE DERIVATIVES; MICROBIOCIDES OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1997-01-07 US disclosed
US-5563138-A 4-OXOQUINOLINE-3-CARBOXYLIC ACID COMPOUNDS HAVING ANTIMICROBIAL ACTIVITY OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1996-10-08 US disclosed
US-5495020-A CHEMICAL INTERMEDIATE FOR BACTERICIDES, MICROBIOCIDES, DISINFECTANTS; SIDE EFFECT REDUCTION, ABSORPTION OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1996-02-27 US disclosed
US-5290934-A Benzoheterocyclic compounds OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1994-03-01 US disclosed
EP-0565132-A2 Benzoheterocyclic compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-10-13 EP disclosed
US-4855292-A ANTIMICROBIAL AGENTS OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1989-08-08 US disclosed
EP-0287951-A2 7-Piperazinyl- or 7-Morpholino-4-oxo-quinoline-3-carboxylic acid derivatives, their preparation and their use as antimicrobial agents OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1988-10-26 EP disclosed