SCHEMBL6763276

SCHEMBL6763276

CC(C)N1CCN(CC(=O)N[C@@H](CNC(=O)CCc2ccccc2Cl)Cc2c[nH]c3ccccc23)CC1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 18/20 0.56
MAPT P10636 1/20 0.51
BRS3 P32247 1/20 0.49

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
SCHEMBL6764703 0.90 TACR1 (0.64) TACR1
SCHEMBL6767352 0.89 TACR1 (0.68) TACR1
SCHEMBL6764654 0.86 TACR1 (0.58) TACR1BRS3
SCHEMBL6299711 0.85 TACR1 (0.70) TACR1MAPTBRS3
SCHEMBL6763275 0.82 TACR1 (0.82) TACR1
SCHEMBL6767454 0.80 TACR1 (0.51) TACR1MAPTBRS3
SCHEMBL6762526 0.80 TACR1 (0.79) TACR1
SCHEMBL7035504 0.80 TACR1 (0.63) TACR1
SCHEMBL6762332 0.77 TACR1 (0.47) TACR1MAPT
SCHEMBL6763282 0.77 TACR1 (0.71) TACR1

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-6727255-B1 BRAIN, NERVOUS SYSTEM AND PSYCHOLOGICAL DISORDERS ELI LILLY AND COMPANY 2004-04-27 US claimed
EP-0729468-B1 NON-PEPTIDE TACHYKININ RECEPTOR ANTAGONISTS LILLY CO ELI (US) 2003-01-15 EP claimed
WO-1995014017-A1 NON-PEPTIDE TACHYKININ RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1995-05-26 WO claimed