SCHEMBL7307909

SCHEMBL7307909

CN(CC(CCCOS(C)(=O)=O)c1ccc(Cl)c(Cl)c1)C(=O)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TACR2 P21452 17/20 0.60
TACR1 P25103 1/20 0.54

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
SCHEMBL4984205 0.94 TACR2 (0.62) TACR2TACR1
SCHEMBL6425161 0.84 TACR2 (0.65) TACR2TACR1
SCHEMBL7313105 0.84 TACR2 (0.67) TACR2TACR1
SCHEMBL6609213 0.84 TACR2 (0.62) TACR2TACR1
SCHEMBL9318213 0.83 TACR2 (0.47) TACR2TACR1
SCHEMBL7306571 0.82 TACR2 (0.40) TACR2TACR1
SCHEMBL8315120 0.82 TACR2 (0.49) TACR2TACR1
SCHEMBL4873822 0.82 TACR2 (0.70) TACR2TACR1
SCHEMBL4610521 0.82 TACR2 (0.70) TACR2TACR1
SCHEMBL14263854 0.82 TACR2 (0.70) TACR2TACR1

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
US-6294537-B1 NEUROKININS USED FOR TREATMENT OF DISEASES SANOFI-SYNTHELABO (FR) 2001-09-25 US disclosed
US-6124316-A ACTIVE DRUG TREATING PSYCHIATRIC DISEASES, DISEASES OF PSYCHOSOMATIC ORIGIN, OF HYPERTENSION AND, NERVOUS SYSTEM DISORDERS SANOFI (FR) 2000-09-26 US disclosed
US-5942523-A NOVEL PIPERIDINE DERIVATIVES WHOSE SPECIFIC STRUCTURE INCLUDES AT POSITION 1 AN ALKYL CHAIN HAVING A 3,4-DICHLOROPHENYL GROUP ATTACHED; HIGH SELECTIVITY TO THE NK3 RECEPTOR; UNIT DOSAGE FORM; TREATING PSYCHIATRIC DISEASES SANOFI (FR) 1999-08-24 US disclosed
US-5741910-A PIPERIDINE DERIVATIVE INTERMEDIATES SANOFI (FR) 1998-04-21 US disclosed
EP-0673928-A1 Novel N-(3,4-dichlorophenyl-propyl)-piperidine derivatives as selective human NK3-receptor antagonists SANOFI (FR) 1995-09-27 EP disclosed