SCHEMBL6983476

SCHEMBL6983476

CC(=O)N(Cc1ccccc1Cl)C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN1CCNCC1C1CCCCC1

nearest known ligand 0.68

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 20/20 0.68

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
SCHEMBL7778001 0.91 TACR1 (0.71) TACR1
SCHEMBL6767451 0.87 TACR1 (0.84) TACR1
SCHEMBL6762332 0.84 TACR1 (0.47) TACR1
SCHEMBL6762331 0.83 TACR1 (0.89) TACR1
SCHEMBL6299708 0.81 TACR1 (1.00) TACR1
SCHEMBL6764651 0.80 TACR1 (0.82) TACR1
SCHEMBL6763275 0.79 TACR1 (0.82) TACR1
SCHEMBL6767350 0.78 TACR1 (1.00) TACR1
SCHEMBL6760501 0.78 TACR1 (0.86) TACR1
SCHEMBL6299831 0.77 TACR1 (0.50) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0729468-B1 NON-PEPTIDE TACHYKININ RECEPTOR ANTAGONISTS LILLY CO ELI (US) 2003-01-15 EP claimed