SCHEMBL11067262

SCHEMBL11067262

CCOC(=O)c1cn(CC)c2cc(N3CCN(C)CC3)c(F)cc2c1=O

nearest known ligand 0.80

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.80
ALDH1A1 P00352 8/20 0.80
HPGD P15428 4/20 0.80
HSD17B10 Q99714 2/20 0.80
DRD3 P35462 1/20 0.77
GAA P10253 1/20 0.73
RAD52 P43351 1/20 0.73
MEN1 O00255 5/20 0.71
KMT2A Q03164 5/20 0.71
NPC1 O15118 1/20 0.71
GLA P06280 1/20 0.67
LMNA P02545 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
SCHEMBL11406037 0.91 KDM4E (0.67) KDM4EALDH1A1HPGDHSD17B10DRD3
SCHEMBL13923341 0.91 DRD3 (0.79) KDM4EALDH1A1HPGDHSD17B10DRD3
SCHEMBL32659736 0.91 KDM4E (0.81) KDM4EALDH1A1HPGDHSD17B10DRD3
SCHEMBL9344503 0.89 KDM4E (0.79) KDM4EALDH1A1HPGDHSD17B10DRD3
Pefloxacin SCHEMBL34292 0.87 DRD3 (1.00) KDM4EALDH1A1HPGDHSD17B10DRD3
Pefloxacin SCHEMBL28251251 0.87 DRD3 (1.00) KDM4EALDH1A1HPGDHSD17B10DRD3
SCHEMBL10027766 0.87 DRD3 (0.84) KDM4EALDH1A1HPGDHSD17B10DRD3
Pefloxacin SCHEMBL29351730 0.87 DRD3 (1.00) KDM4EALDH1A1HPGDHSD17B10DRD3
Pefloxacin SCHEMBL8184732 0.86 DRD3 (0.98) KDM4EALDH1A1HPGDHSD17B10DRD3
Pefloxacin SCHEMBL10911017 0.86 DRD3 (0.98) KDM4EALDH1A1HPGDHSD17B10DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4472579-A REACTING A PIPERAZINE WITH A CHLORO QUINOLINECARBOXYLIC ACID ESTER, HYDROLYSIS KYORIN SEIYAKU KABUSHIKI KAISHA (JP) 1984-09-18 US disclosed