SCHEMBL8556212

SCHEMBL8556212

Cc1c(F)c(N2CCN(C)CC2)cc2c1c(=O)c(C(=O)O)cn2-c1ccc(F)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.69
MEN1 O00255 2/20 0.69
KMT2A Q03164 2/20 0.69
KDM4E B2RXH2 6/20 0.52
ALDH1A1 P00352 5/20 0.52
HPGD P15428 2/20 0.52
HSD17B10 Q99714 1/20 0.52
KCNH2 Q12809 1/20 0.47
HRH3 Q9Y5N1 1/20 0.47
DRD3 P35462 1/20 0.46
NPC1 O15118 2/20 0.43
TOP1 P11387 2/20 0.41
TOP2A P11388 1/20 0.41
POLB P06746 1/20 0.41
HSP90AA1 P07900 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
TP53 P04637 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL8558767 0.89 LMNA (0.67) LMNAMEN1KMT2AKDM4EALDH1A1
SCHEMBL8560447 0.88 KMT2A (0.59) LMNAMEN1KMT2AKDM4EALDH1A1
SCHEMBL8137301 0.86 MEN1 (0.52) LMNAMEN1KMT2AKDM4EALDH1A1
Hydrochloric Acid SCHEMBL8137071 0.85 LMNA (0.51) LMNAMEN1KMT2AKDM4EALDH1A1
Hydrochloric Acid SCHEMBL8110971 0.83 KCNH2 (0.51) LMNAMEN1KMT2AKDM4EALDH1A1
SCHEMBL8112233 0.82 LMNA (0.51) LMNAMEN1KMT2AKDM4EALDH1A1
Difloxacin SCHEMBL29695838 0.82 LMNA (1.00) LMNAMEN1KMT2AKDM4EALDH1A1
Difloxacin SCHEMBL148765 0.82 LMNA (1.00) LMNAMEN1KMT2AKDM4EALDH1A1
Difloxacin SCHEMBL203110 0.81 LMNA (0.98) LMNAMEN1KMT2AKDM4EALDH1A1
Difloxacin SCHEMBL27973383 0.80 LMNA (0.96) LMNAMEN1KMT2AKDM4EALDH1A1

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