SCHEMBL7745546

SCHEMBL7745546

CC(=O)N(Cc1ccc(C)c(C)c1)C(=O)C(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(C2CCCCC2)CC1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 16/20 0.58
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
BRS3 P32247 2/20 0.46
PSMB8 P28062 1/20 0.46
PSMB9 P28065 1/20 0.46

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
SCHEMBL7737676 0.94 TACR1 (0.59) TACR1BRS3PSMB8PSMB9
SCHEMBL7743797 0.94 TACR1 (0.60) TACR1MEN1KMT2ASMN1; SMN2BRS3
SCHEMBL7745538 0.92 TACR1 (0.58) TACR1MEN1KMT2ASMN1; SMN2BRS3
SCHEMBL7737671 0.91 TACR1 (0.56) TACR1MEN1KMT2ASMN1; SMN2BRS3
SCHEMBL7742425 0.91 TACR1 (0.58) TACR1MEN1KMT2ASMN1; SMN2BRS3
SCHEMBL7743039 0.91 TACR1 (0.62) TACR1MEN1KMT2ASMN1; SMN2BRS3
SCHEMBL7743129 0.90 TACR1 (0.64) TACR1KMT2A
SCHEMBL7737705 0.89 TACR1 (0.64) TACR1MEN1KMT2ASMN1; SMN2BRS3
SCHEMBL7742271 0.89 TACR1 (0.58) TACR1MEN1KMT2ASMN1; SMN2BRS3
SCHEMBL7737724 0.89 TACR1 (0.60) TACR1MEN1KMT2ASMN1; SMN2BRS3

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