SCHEMBL7743784

SCHEMBL7743784

CN(Cc1cc(Cl)c(Cl)c(Cl)c1)C(=O)C(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(C2CCCCC2)CC1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 16/20 0.56
BRS3 P32247 2/20 0.49
NMBR P28336 1/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
TACR2 P21452 2/20 0.47

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
SCHEMBL7743573 0.94 TACR1 (0.62) TACR1BRS3NMBRTACR2
SCHEMBL7743541 0.94 TACR1 (0.56) TACR1BRS3NMBRMEN1KMT2A
SCHEMBL7743547 0.91 TACR1 (0.58) TACR1BRS3MEN1KMT2ASMN1; SMN2
SCHEMBL7743556 0.91 TACR1 (0.57) TACR1BRS3NMBRMEN1KMT2A
SCHEMBL7743815 0.91 TACR1 (0.64) TACR1BRS3NMBRMEN1KMT2A
SCHEMBL7742321 0.90 TACR1 (0.58) TACR1BRS3NMBRMEN1KMT2A
SCHEMBL7743551 0.89 TACR1 (0.61) TACR1BRS3NMBRMEN1KMT2A
SCHEMBL7743191 0.89 TACR1 (0.62) TACR1BRS3NMBRMEN1KMT2A
SCHEMBL7742307 0.89 TACR1 (0.64) TACR1MEN1KMT2ATACR2
SCHEMBL7737671 0.88 TACR1 (0.56) TACR1BRS3NMBRMEN1KMT2A

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 8 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 claimed
EP-0819005-A1 2-ACYLAMINOPROPANAMIDES AS TACHYKININ RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1998-01-21 EP claimed
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
WO-1996031214-A1 2-ACYLAMINOPROPANAMIDES AS TACHYKININ RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1996-10-10 WO claimed
EP-0761220-A1 2-Acylaminopropanamides as growth hormone secretagogues ELI LILLY AND COMPANY (US) 1997-03-12 EP 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