SCHEMBL7372947

SCHEMBL7372947

Nc1cc(O)c(C(=O)NCC2CN(Cc3cccc(F)c3)CCO2)cc1Cl

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 3/20 0.64
KCNH2 Q12809 2/20 0.64
CYP1A2 P05177 2/20 0.64
CYP2C9 P11712 2/20 0.64
CYP2C19 P33261 2/20 0.64
MEN1 O00255 1/20 0.64
LMNA P02545 1/20 0.64
CYP3A4 P08684 1/20 0.64
HTR1A P08908 1/20 0.64
ADRA2A P08913 1/20 0.64
ADORA3 P0DMS8 1/20 0.64
ADRA2B P18089 1/20 0.64
HTR2C P28335 1/20 0.64
SLC6A4 P31645 1/20 0.64
HTR2B P41595 1/20 0.64
KMT2A Q03164 1/20 0.64
SIGMAR1 Q99720 1/20 0.64
CCR3 P51677 1/20 0.47
DRD4 P21917 11/20 0.47
DRD2 P14416 2/20 0.47

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
SCHEMBL7366109 0.91 DRD3 (0.59) DRD3KCNH2CYP1A2CYP2C9CYP2C19
SCHEMBL31356433 0.91 DRD3 (0.76) DRD3KCNH2CYP1A2CYP2C9CYP2C19
SCHEMBL7368823 0.91 DRD3 (0.76) DRD3KCNH2CYP1A2CYP2C9CYP2C19
SCHEMBL7365175 0.91 DRD3 (0.63) DRD3KCNH2CYP1A2CYP2C9CYP2C19
SCHEMBL7370912 0.88 DRD3 (0.65) DRD3KCNH2CYP1A2CYP2C9CYP2C19
SCHEMBL7370227 0.86 DRD3 (0.61) DRD3KCNH2CYP1A2CYP2C9CYP2C19
SCHEMBL7371848 0.86 DRD3 (0.57) DRD3KCNH2CYP1A2CYP2C9CYP2C19
SCHEMBL7370724 0.85 DRD3 (0.59) DRD3KCNH2CYP1A2CYP2C9CYP2C19
SCHEMBL7369152 0.84 DRD3 (0.57) DRD3KCNH2CYP1A2CYP2C9CYP2C19
SCHEMBL30133732 0.83 HTR1A (0.54) DRD3KCNH2CYP1A2CYP2C9CYP2C19

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-0243959-B1 SUBSTITUTED BENZAMIDE DERIVATIVES, PROCESSES FOR THE PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME Dainippon Pharmaceutical Co., Ltd. (JP) 1992-08-19 EP disclosed
US-4870074-A Substituted benzamide derivatives, for enhancing gastrointestinal motility DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1989-09-26 US disclosed
EP-0243959-A1 Substituted benzamide derivatives, processes for the preparation thereof, and pharmaceutical compositions containing the same Dainippon Pharmaceutical Co., Ltd. (JP) 1987-11-04 EP disclosed