SCHEMBL7799285

SCHEMBL7799285

COCCN1C2CCC1CC(=NO)C2

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 2/20 0.35
OPRM1 P35372 4/20 0.34
OPRD1 P41143 4/20 0.34
SMYD3 Q9H7B4 1/20 0.31

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
SCHEMBL7809891 0.83 LMNA (0.33) OPRM1OPRD1
SCHEMBL96271 0.77 GBA1 (0.41) GBA1OPRM1OPRD1SMYD3
SCHEMBL7804700 0.77 MAPK1 (0.44) GBA1OPRM1OPRD1SMYD3
SCHEMBL22943654 0.76 SIGMAR1 (0.33)
Hydrochloric Acid SCHEMBL7805841 0.74 SIGMAR1 (0.35)
SCHEMBL7805881 0.73 ACHE (0.35) OPRM1OPRD1
SCHEMBL1114394 0.73 MAPK1 (0.41)
Hydrochloric Acid SCHEMBL7809740 0.71 CHRNA7 (0.40)
SCHEMBL96666 0.71 GBA1 (0.38) GBA1
SCHEMBL14967799 0.71 LMNA (0.50) GBA1SMYD3

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