SCHEMBL2849523

SCHEMBL2849523

CCn1cc(OC(=O)O)c(=O)c2cc(F)c(N3CCN(C)CC3)cc21

nearest known ligand 0.76

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 1/20 0.76
KDM4E B2RXH2 10/20 0.69
ALDH1A1 P00352 8/20 0.69
MEN1 O00255 5/20 0.69
KMT2A Q03164 5/20 0.69
HPGD P15428 4/20 0.69
NPC1 O15118 1/20 0.69
GAA P10253 1/20 0.68
RAD52 P43351 1/20 0.68
GLA P06280 1/20 0.63
LMNA P02545 2/20 0.62
HSD17B10 Q99714 2/20 0.62
BRD4 O60885 1/20 0.62
TSHR P16473 1/20 0.62
HTT P42858 1/20 0.62
CYP2J2 P51589 1/20 0.62
NPSR1 Q6W5P4 1/20 0.62

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
SCHEMBL7809358 0.92 ALDH1A1 (0.76) DRD3KDM4EALDH1A1MEN1KMT2A
SCHEMBL7824016 0.92 DRD3 (0.63) DRD3KDM4EALDH1A1MEN1KMT2A
SCHEMBL2858133 0.90 KDM4E (0.77) DRD3KDM4EALDH1A1MEN1KMT2A
SCHEMBL10913829 0.89 DRD3 (0.68) DRD3KDM4EALDH1A1MEN1KMT2A
SCHEMBL10359339 0.86 HSD17B10 (0.65) DRD3KDM4EALDH1A1MEN1KMT2A
Pefloxacin SCHEMBL34292 0.86 DRD3 (1.00) DRD3KDM4EALDH1A1MEN1KMT2A
Pefloxacin SCHEMBL29351730 0.86 DRD3 (1.00) DRD3KDM4EALDH1A1MEN1KMT2A
Pefloxacin SCHEMBL28251251 0.86 DRD3 (1.00) DRD3KDM4EALDH1A1MEN1KMT2A
Pefloxacin SCHEMBL10911017 0.85 DRD3 (0.98) DRD3KDM4EALDH1A1MEN1KMT2A
Pefloxacin SCHEMBL9800276 0.85 DRD3 (0.98) DRD3KDM4EALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1408034-B1 Use of Quinolone and Quinolizinone derivatives as chemotherapeutic agents SCHULZ & SCHLIMBACH GBR (DE) 2007-08-08 EP claimed
EP-1408034-A1 Use of Quinoline derivatives as antibacterial agents Schulz & Schlimbach GbR (DE) 2004-04-14 EP claimed
EP-1244434-A2 USE OF CHEMOTHERAPEUTIC AGENTS Schulz, Hans-Herrmann (DE) 2002-10-02 EP claimed
WO-2001045679-A2 USE OF CHEMOTHERAPEUTIC AGENTS FOR TOPICAL TREATMENT SCHULZ HANS HERRMANN (DE) 2001-06-28 WO claimed
EP-0210513-A1 Preparations for the treatment of mycoplasmoses and bacterial infections in poultry BAYER AG (DE) 1987-02-04 EP claimed
EP-1682144-B1 PHARMACEUTICAL FORMULATIONS CONTAINING FLAVOURING SUBSTANCES WITH IMPROVED PHARMACEUTICAL PROPERTIES BAYER ANIMAL HEALTH GMBH (DE) 2010-01-13 EP disclosed
EP-2080515-A1 Pharmaceutical formulations containing flavouring substances with improved pharmaceutical properties Bayer Animal Health GmbH (DE) 2009-07-22 EP disclosed
EP-1408034-B1 Use of Quinolone and Quinolizinone derivatives as chemotherapeutic agents SCHULZ & SCHLIMBACH GBR (DE) 2007-08-08 EP disclosed
EP-1682144-A1 PHARMACEUTICAL FORMULATIONS CONTAINING FLAVOURING SUBSTANCES WITH IMPROVED PHARMACEUTICAL PROPERTIES Bayer HealthCare AG (DE) 2006-07-26 EP disclosed
WO-2005044271-A1 PHARMACEUTICAL FORMULATIONS CONTAINING FLAVOURING SUBSTANCES WITH IMPROVED PHARMACEUTICAL PROPERTIES BAYER HEALTHCARE AG (DE) 2005-05-19 WO disclosed
EP-1408034-A1 Use of Quinoline derivatives as antibacterial agents Schulz & Schlimbach GbR (DE) 2004-04-14 EP disclosed
EP-1244434-A2 USE OF CHEMOTHERAPEUTIC AGENTS Schulz, Hans-Herrmann (DE) 2002-10-02 EP disclosed
EP-0828715-B1 N-OXIDES AS ANTIBACTERIAL AGENTS BAYER AG (DE) 2001-08-16 EP disclosed
WO-2001045679-A2 USE OF CHEMOTHERAPEUTIC AGENTS FOR TOPICAL TREATMENT SCHULZ HANS HERRMANN (DE) 2001-06-28 WO disclosed
EP-0270904-A2 Process for the preparation of quinoloncarboxylate esters BAYER AG (DE) 1988-06-15 EP disclosed
EP-0210513-A1 Preparations for the treatment of mycoplasmoses and bacterial infections in poultry BAYER AG (DE) 1987-02-04 EP disclosed
EP-0209000-A2 Embonates of quinoline-carboxylic acids and their derivatives BAYER AG (DE) 1987-01-21 EP disclosed
EP-0205029-A2 Quinolinecarboxylic acids with an antibacterial activity BAYER AG (DE) 1986-12-17 EP disclosed