SCHEMBL7307778

SCHEMBL7307778

CN(CC(CCCOC1CCCCO1)c1ccc(Cl)c(Cl)c1)C(=O)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TACR2 P21452 19/20 0.59

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
SCHEMBL6422995 0.95 TACR2 (0.58) TACR2
SCHEMBL8368093 0.83 TACR2 (0.44) TACR2
SCHEMBL7305547 0.83 MEN1 (0.43) TACR2
SCHEMBL8971656 0.83 TACR2 (0.45) TACR2
SCHEMBL8971591 0.82 TACR2 (0.47) TACR2
SCHEMBL9318295 0.82 TACR2 (0.45) TACR2
SCHEMBL8695178 0.81 TACR2 (0.43) TACR2
SCHEMBL8479637 0.80 TACR2 (0.43) TACR2
SCHEMBL7306485 0.79 SLC6A3 (0.45) TACR2
SCHEMBL8971567 0.79 TACR2 (0.42) TACR2

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
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
EP-0673928-A1 Novel N-(3,4-dichlorophenyl-propyl)-piperidine derivatives as selective human NK3-receptor antagonists SANOFI (FR) 1995-09-27 EP disclosed