SCHEMBL7799387

SCHEMBL7799387

COCCN1C2CCC1CC(N)C2

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 2/20 0.35
DRD2 P14416 1/20 0.31
DRD4 P21917 1/20 0.31
DRD3 P35462 1/20 0.31
SMYD3 Q9H7B4 1/20 0.31
PTPN11 Q06124 1/20 0.30

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
SCHEMBL8183912 1.00 GBA1 (0.35) GBA1DRD2DRD4DRD3SMYD3
Hydrochloric Acid SCHEMBL7806303 0.98 GBA1 (0.34) GBA1DRD2DRD4DRD3SMYD3
Hydrochloric Acid SCHEMBL7806305 0.98 GBA1 (0.34) GBA1DRD2DRD4DRD3SMYD3
SCHEMBL96271 0.83 GBA1 (0.41) GBA1SMYD3
SCHEMBL26157412 0.82 GBA1 (0.36) GBA1DRD2DRD4DRD3SMYD3
SCHEMBL7805795 0.81 LMNA (0.38) DRD2DRD4DRD3
SCHEMBL7805796 0.81 LMNA (0.38) DRD2DRD4DRD3
SCHEMBL23588763 0.80 DRD2 (0.37) GBA1DRD2DRD4DRD3
SCHEMBL14967796 0.80 GBA1 (0.35) GBA1DRD2DRD4DRD3SMYD3
SCHEMBL14967799 0.80 LMNA (0.50) GBA1DRD2DRD4DRD3SMYD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0710662-B1 QUINOLINECARBOXYLIC ACID DERIVATIVE SYNGENTA LTD (GB) 2001-04-04 EP disclosed
EP-1018513-A2 Quinolinecarboxylic acid derivatives ZENECA LIMITED (GB) 2000-07-12 EP disclosed
EP-0710662-A1 QUINOLINECARBOXYLIC ACID DERIVATIVE TAISHO PHARMACEUTICAL CO. LTD (JP) 1996-05-08 EP disclosed