SCHEMBL8560447

SCHEMBL8560447

Cc1c(F)c(N2CCN(C)CC2)cc2c1c(=O)c(C(=O)O)cn2-c1ccc(F)cc1F

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.59
LMNA P02545 3/20 0.59
MEN1 O00255 2/20 0.59
ALDH1A1 P00352 5/20 0.49
DRD3 P35462 1/20 0.49
KCNH2 Q12809 1/20 0.46
HRH3 Q9Y5N1 1/20 0.46
KDM4E B2RXH2 6/20 0.46
HPGD P15428 3/20 0.46
NPC1 O15118 1/20 0.46
HSD17B10 Q99714 2/20 0.44
EPHA2 P29317 1/20 0.42
FLT4 P35916 1/20 0.42
GSK3B P49841 1/20 0.42
RARB P10826 1/20 0.42
TBXAS1 P24557 1/20 0.42
SLC6A3 Q01959 1/20 0.42
TOP1 P11387 2/20 0.42
TOP2A P11388 1/20 0.42
POLB P06746 2/20 0.41

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
SCHEMBL8621440 0.90 LMNA (0.57) KMT2ALMNAMEN1ALDH1A1DRD3
Hydrochloric Acid SCHEMBL8554393 0.89 LMNA (0.58) KMT2ALMNAMEN1ALDH1A1DRD3
SCHEMBL8556212 0.88 LMNA (0.69) KMT2ALMNAMEN1ALDH1A1DRD3
SCHEMBL5868715 0.88 KMT2A (0.55) KMT2ALMNAMEN1ALDH1A1KCNH2
SCHEMBL9317498 0.87 LMNA (0.45) KMT2ALMNAMEN1ALDH1A1DRD3
SCHEMBL5868688 0.86 KCNH2 (0.49) KMT2ALMNAMEN1ALDH1A1KCNH2
SCHEMBL8557898 0.85 KMT2A (0.52) KMT2ALMNAMEN1ALDH1A1DRD3
SCHEMBL8102487 0.85 EPHA2 (0.43) KMT2ALMNAMEN1ALDH1A1KCNH2
SCHEMBL8625264 0.84 KMT2A (0.60) KMT2ALMNAMEN1ALDH1A1KCNH2
SCHEMBL8623001 0.84 KCNH2 (0.54) KMT2ALMNAMEN1ALDH1A1KCNH2

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 8 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-5563138-A 4-OXOQUINOLINE-3-CARBOXYLIC ACID COMPOUNDS HAVING ANTIMICROBIAL ACTIVITY OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1996-10-08 US disclosed
EP-0287951-B1 7-Piperazinyl- or 7-Morpholino-4-oxo-quinoline-3-carboxylic acid derivatives, their preparation and their use as antimicrobial agents OTSUKA PHARMA CO LTD (JP) 1996-07-03 EP 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
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