SCHEMBL7743639

SCHEMBL7743639

CCOc1cc(CN(C(C)=O)C(=O)C(Cc2c[nH]c3ccccc23)NC(=O)CN2CCN(c3ccccc3)CC2)cc(OCC)c1OCC

nearest known ligand 0.59

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 20/20 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
SCHEMBL7742421 0.93 TACR1 (0.59) TACR1
SCHEMBL7737727 0.91 TACR1 (0.57) TACR1
SCHEMBL7737723 0.91 TACR1 (0.63) TACR1
SCHEMBL7743624 0.90 TACR1 (0.63) TACR1
SCHEMBL7743746 0.88 TACR1 (0.62) TACR1
SCHEMBL7743539 0.88 TACR1 (0.64) TACR1
SCHEMBL7743738 0.88 TACR1 (0.58) TACR1
SCHEMBL7743066 0.87 TACR1 (0.64) TACR1
SCHEMBL7743812 0.87 TACR1 (0.64) TACR1
SCHEMBL7745581 0.87 TACR1 (0.62) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0819005-A4 2-ACYLAMINOPROPANAMIDES AS TACHYKININ RECEPTOR ANTAGONISTS LILLY CO ELI (US) 2001-03-21 EP disclosed
EP-0819005-A1 2-ACYLAMINOPROPANAMIDES AS TACHYKININ RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1998-01-21 EP disclosed
EP-0761220-A1 2-Acylaminopropanamides as growth hormone secretagogues ELI LILLY AND COMPANY (US) 1997-03-12 EP disclosed
WO-1997006803-A1 2-ACYLAMINOPROPANAMIDES AS GROWTH HORMONE SECRETAGOGUES ELI LILLY AND COMPANY (US) 1997-02-27 WO disclosed
US-5565568-A USEFUL IN TREATMENT OR PREVENTION OF A PHYSIOLOGICAL DISORDER ASSOCIATED WITH AN EXCESS OF TACHYKININS ELI LILLY AND COMPANY (US) 1996-10-15 US disclosed
WO-1996031214-A1 2-ACYLAMINOPROPANAMIDES AS TACHYKININ RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1996-10-10 WO disclosed