SCHEMBL7743793

SCHEMBL7743793

CCOc1ccc(CNC(=O)C(Cc2c[nH]c3ccccc23)NC(=O)CN2CCN(C3CCCCC3)CC2)cc1OCC

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 8/20 0.54
BRS3 P32247 2/20 0.54
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
NMBR P28336 2/20 0.47
MAPT P10636 2/20 0.46
GAA P10253 1/20 0.46
HTT P42858 1/20 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
SCHEMBL7745641 0.94 BRS3 (0.55) TACR1BRS3KMT2ANMBRMAPT
SCHEMBL7743028 0.93 TACR1 (0.54) TACR1BRS3KMT2AMEN1SMN1; SMN2
SCHEMBL7737733 0.91 TACR1 (0.59) TACR1BRS3KMT2AMEN1SMN1; SMN2
SCHEMBL7743615 0.91 TACR1 (0.60) TACR1BRS3KMT2AMEN1SMN1; SMN2
SCHEMBL7742413 0.90 BRS3 (0.56) TACR1BRS3KMT2AMEN1SMN1; SMN2
SCHEMBL7742495 0.89 SSTR2 (0.51) TACR1BRS3KMT2AMEN1SMN1; SMN2
SCHEMBL7743760 0.88 BRS3 (0.56) TACR1BRS3KMT2AMEN1SMN1; SMN2
SCHEMBL7737709 0.88 TACR1 (0.55) TACR1BRS3KMT2AMEN1SMN1; SMN2
SCHEMBL7745651 0.87 TACR1 (0.58) TACR1BRS3KMT2AMEN1SMN1; SMN2
SCHEMBL8748207 0.87 BRS3 (0.55) TACR1BRS3NMBRMAPTGAA

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0761220-A1 2-Acylaminopropanamides as growth hormone secretagogues ELI LILLY AND COMPANY (US) 1997-03-12 EP claimed
WO-1997006803-A1 2-ACYLAMINOPROPANAMIDES AS GROWTH HORMONE SECRETAGOGUES ELI LILLY AND COMPANY (US) 1997-02-27 WO claimed
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 claimed
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