SCHEMBL10759142

SCHEMBL10759142

CCNC(Cc1ccccc1)CN(C)C

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.55
SLC6A4 P31645 3/20 0.46
HTR2A P28223 1/20 0.42
HRH1 P35367 1/20 0.42

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
SCHEMBL27173944 0.85 SIGMAR1 (0.67) SIGMAR1SLC6A4
SCHEMBL13060794 0.81 TAAR1 (0.52) SIGMAR1SLC6A4HTR2AHRH1
SCHEMBL1618760 0.81 TAAR1 (0.52) SIGMAR1SLC6A4HTR2AHRH1
SCHEMBL1618758 0.81 TAAR1 (0.52) SIGMAR1SLC6A4HTR2AHRH1
Hydrochloric Acid SCHEMBL6738145 0.81 SIGMAR1 (0.56) SIGMAR1
SCHEMBL22558398 0.81 SLC6A4 (0.62) SIGMAR1SLC6A4
SCHEMBL13061020 0.80 SIGMAR1 (0.41) SIGMAR1SLC6A4HTR2AHRH1
SCHEMBL23137160 0.79 HTR2A (0.42) SIGMAR1SLC6A4HTR2AHRH1
SCHEMBL13006637 0.79 SIGMAR1 (0.47) SIGMAR1SLC6A4HTR2AHRH1
SCHEMBL13006613 0.79 SIGMAR1 (0.47) SIGMAR1SLC6A4HTR2AHRH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0122018-B1 IMPROVEMENTS IN AND RELATING TO PHARMACOLOGICALLY ACTIVE TRIPEPTIDE DERIVATIVES ELI LILLY AND COMPANY (US) 1987-09-02 EP disclosed
US-4510082-A NONHABIT-FORMING ANALGESICS ELI LILLY AND COMPANY (US) 1985-04-09 US disclosed
EP-0122018-A2 Improvements in and relating to pharmacologically active tripeptide derivatives ELI LILLY AND COMPANY (US) 1984-10-17 EP disclosed
US-4473497-A Pharmacologically active peptides ELI LILLY AND COMPANY (US) 1984-09-25 US disclosed