SCHEMBL8829903

SCHEMBL8829903

CC(Cc1c[nH]c2ccccc12)(NC(=O)O)C(=O)NCCC1CCCCC1

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NMBR P28336 2/20 0.60
CCKBR P32239 4/20 0.56
BCHE P06276 2/20 0.54

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
SCHEMBL8829899 1.00 NMBR (0.60) NMBRCCKBRBCHE
SCHEMBL8829876 0.84 CCKBR (0.68) NMBRCCKBR
SCHEMBL6181070 0.84 NMBR (0.86) NMBRCCKBR
SCHEMBL8829853 0.83 CCKBR (0.55) NMBRCCKBR
SCHEMBL6892425 0.83 CCKBR (0.78) NMBRCCKBR
SCHEMBL8829915 0.82 CCKBR (0.56) NMBRCCKBR
SCHEMBL8198181 0.82 NMBR (0.59) NMBR
SCHEMBL8198180 0.82 NMBR (0.59) NMBR
SCHEMBL9017344 0.81 NMBR (0.60) NMBR
SCHEMBL9377083 0.80 CCKBR (0.52) NMBRCCKBR

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
US-5631281-A COMPOUNDS FOR TREATMENT OF ANXIETY WITH INDOLE AMIDES WARNER-LAMBERT COMPANY (US) 1997-05-20 US disclosed
US-5622983-A ANTIOBESITY AGENTS, ANTIPSYCHOTIC AGENTS, ANTIULCER AGENTS WARNER-LAMBERT COMPANY (US) 1997-04-22 US disclosed
US-5580896-A Treatment of pain and colorectal cancer with dipeptoids of α-substituted Trp-Phe derivatives WARNER-LAMBERT COMPANY (US) 1996-12-03 US disclosed
US-5278316-A Indoles WARNER-LAMBERT COMPANY (US) 1994-01-11 US disclosed