SCHEMBL8525768

SCHEMBL8525768

CCCCN1CCC(NC(=O)c2cc(OC)c3ccccc3c2OC)CC1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 8/20 0.61
SSTR5 P35346 3/20 0.60
DRD3 P35462 4/20 0.57
DRD2 P14416 3/20 0.57
DRD4 P21917 3/20 0.57
HTR4 Q13639 2/20 0.56
KDM4E B2RXH2 1/20 0.54
MEN1 O00255 1/20 0.54
MAPT P10636 1/20 0.54
KMT2A Q03164 1/20 0.54
SLC6A12 P48065 1/20 0.52

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
Hydrochloric Acid SCHEMBL9092182 0.99 SIGMAR1 (0.60) SIGMAR1SSTR5DRD3DRD2DRD4
SCHEMBL8526596 0.90 SIGMAR1 (0.75) SIGMAR1DRD3DRD2DRD4
SCHEMBL8525826 0.86 SIGMAR1 (0.57) SIGMAR1DRD3DRD2DRD4HTR4
SCHEMBL8526305 0.83 SSTR5 (0.52) SIGMAR1SSTR5DRD3DRD2DRD4
Hydrochloric Acid SCHEMBL8529638 0.82 SSTR5 (0.51) SIGMAR1SSTR5DRD3DRD2DRD4
SCHEMBL8526537 0.78 SIGMAR1 (0.58) SIGMAR1DRD3DRD2DRD4
SCHEMBL8525976 0.76 SIGMAR1 (1.00) SIGMAR1DRD3DRD2DRD4SLC6A12
SCHEMBL11938908 0.74 ADRA1D (0.74) SIGMAR1DRD4MEN1KMT2ASLC6A12
SCHEMBL8127075 0.73 SIGMAR1 (0.75) SIGMAR1DRD3DRD2
Hydrochloric Acid SCHEMBL9229456 0.72 SIGMAR1 (0.52) SIGMAR1SSTR5DRD3DRD2

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-0539281-B1 Naphthamides, process for their preparation and their application in the therapeutical field INST NAT SANTE RECH MED (FR) 1998-12-30 EP claimed
EP-0539281-B1 Naphthamides, process for their preparation and their application in the therapeutical field INST NAT SANTE RECH MED (FR) 1998-12-30 EP disclosed
EP-0539281-A1 New naphthamides, process for their preparation and their application in the therapeutical field INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 1993-04-28 EP disclosed