SCHEMBL8527005

SCHEMBL8527005

CCN1CCCC1CNC(=O)c1cc(Cl)c2ccccc2c1OC

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.68
DRD2 P14416 7/20 0.67
KDM4E B2RXH2 3/20 0.64
CYP1A2 P05177 2/20 0.64
CYP2D6 P10635 2/20 0.64
CYP2C9 P11712 2/20 0.64
DRD3 P35462 2/20 0.64
ALDH1A1 P00352 1/20 0.64
CYP3A4 P08684 1/20 0.64
ALOX15 P16050 1/20 0.64
MAPK1 P28482 1/20 0.64
DRD1 P21728 1/20 0.63
DRD4 P21917 1/20 0.63
DRD5 P21918 1/20 0.63
CYP2C19 P33261 1/20 0.63
KMT2A Q03164 1/20 0.63
HSD17B10 Q99714 1/20 0.63

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 SCHEMBL9091536 0.99 SIGMAR1 (0.67) SIGMAR1DRD2KDM4ECYP1A2CYP2D6
SCHEMBL8526450 0.93 DRD3 (0.68) SIGMAR1DRD2KDM4ECYP1A2CYP2D6
SCHEMBL8528423 0.91 SIGMAR1 (0.81) SIGMAR1DRD2KDM4ECYP1A2CYP2D6
SCHEMBL8526014 0.90 DRD2 (0.65) SIGMAR1DRD2KDM4ECYP1A2CYP2D6
SCHEMBL8526543 0.89 DRD3 (0.68) SIGMAR1DRD2KDM4ECYP1A2CYP2D6
SCHEMBL8527031 0.88 SIGMAR1 (0.82) SIGMAR1DRD2DRD3
SCHEMBL8527239 0.88 SIGMAR1 (0.65) SIGMAR1DRD2KDM4ECYP1A2CYP2D6
Hydrochloric Acid SCHEMBL9088683 0.88 DRD3 (0.67) SIGMAR1DRD2KDM4ECYP1A2CYP2D6
Hydrochloric Acid SCHEMBL9092327 0.87 SIGMAR1 (0.81) SIGMAR1DRD2DRD3
Hydrochloric Acid SCHEMBL9091200 0.87 SIGMAR1 (0.64) SIGMAR1DRD2KDM4ECYP1A2CYP2D6

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 5 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-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 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
US-5498628-A ANTIPSYCHOTIC, PSYCHOSTIMULATORY, ANTIAUTISTIC, ANTIDEPRESSANT AND HYPOTENSIVE AGENTS, PARKINSON'S DISEASE INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (FR) 1996-03-12 US 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