SCHEMBL9021909

SCHEMBL9021909

COc1cc(NC(C)=O)c(Cl)cc1C(=O)NC1CC2CCC(C1)N2C

nearest known ligand 0.72

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 2/20 0.72
DRD4 P21917 8/20 0.53

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
SCHEMBL9021444 0.96 HTR4 (0.66) HTR4DRD4
SCHEMBL7296558 0.92 HTR4 (0.60) HTR4DRD4
SCHEMBL9022207 0.91 HTR4 (0.59) HTR4DRD4
SCHEMBL9022232 0.87 DRD4 (0.55) HTR4DRD4
SCHEMBL6953456 0.84 DRD4 (0.63) DRD4
SCHEMBL9021757 0.84 HTR4 (0.71) HTR4DRD4
SCHEMBL4891270 0.84 HTR4 (0.52) HTR4DRD4
SCHEMBL9021658 0.84 HTR4 (0.52) HTR4DRD4
SCHEMBL7353293 0.84 HTR4 (0.51) HTR4DRD4
SCHEMBL8722682 0.84 HTR4 (1.00) HTR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0640601-B1 BENZAMIDE DERIVATIVE HOKURIKU PHARMACEUTICAL (JP) 1996-12-04 EP disclosed
US-5500422-A FOR TREATING GASTROINTESTINAL DISEASES HOKURIKU SEIYAKU CO. LTD. (JP) 1996-03-19 US disclosed
US-5395832-A Gastrointestinal disorders HOKURIKU SEIYAKU CO., LTD. (JP) 1995-03-07 US disclosed
EP-0640601-A1 BENZAMIDE DERIVATIVE HOKURIKU SEIYAKU CO., LTD. (JP) 1995-03-01 EP disclosed