SCHEMBL6583155

SCHEMBL6583155

COc1cc(N)c(Cl)cc1C(=O)NC1CCN(CC2CCNCC2)CC1

nearest known ligand 0.78

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 5/20 0.76
ACHE P22303 1/20 0.70

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
SCHEMBL6586967 0.91 HTR4 (0.62) HTR4ACHE
SCHEMBL11545317 0.90 HTR4 (0.78) HTR4
Hydrochloric Acid SCHEMBL11552502 0.90 HTR4 (0.76) HTR4
Hydrochloric Acid SCHEMBL11551060 0.90 HTR4 (0.76) HTR4
Hydrochloric Acid SCHEMBL11544953 0.89 HTR4 (0.77) HTR4
Hydrochloric Acid SCHEMBL11544697 0.89 HTR4 (0.77) HTR4
SCHEMBL6584868 0.89 HTR4 (0.64) HTR4ACHE
Hydrochloric Acid SCHEMBL11548799 0.89 HTR4 (0.73) HTR4
SCHEMBL6586516 0.88 HTR4 (0.72) HTR4
SCHEMBL6583133 0.88 HTR4 (0.75) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1076055-B1 1- (1-SUBSTITUTED-4-PIPERIDINYL)METHYL]-4-PIPERIDINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, MEDICINAL COMPOSITIONS CONTAINING THE SAME AND INTERMEDIATES OF THESE COMPOUNDS DAINIPPON PHARMACEUTICAL CO (JP) 2004-11-24 EP disclosed
US-6294555-B1 SEROTONIN HT3 RECEPTOR ANTAGONIST FOR GASTROINTESTINAL DISORDERS DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 2001-09-25 US disclosed
EP-1076055-A1 1- (1-SUBSTITUTED-4-PIPERIDINYL)METHYL]-4-PIPERIDINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, MEDICINAL COMPOSITIONS CONTAINING THE SAME AND INTERMEDIATES OF THESE COMPOUNDS Dainippon Pharmaceutical Co., Ltd. (JP) 2001-02-14 EP disclosed