SCHEMBL7047252

SCHEMBL7047252

CC(Cc1c[nH]c2ccccc12)(C(=O)NC(CO)Cc1ccccc1)C1CCCCC1Cl

nearest known ligand 0.51

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 1/20 0.44

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
SCHEMBL6888677 0.84
SCHEMBL9338573 0.82 CCKBR (0.55) CCKBR
SCHEMBL8829880 0.80 ACE (0.50) CCKBR
SCHEMBL27330226 0.80 ACE (0.50) CCKBR
SCHEMBL8893462 0.80 ACE (0.50)
SCHEMBL9338577 0.79 CCKBR (0.39) CCKBR
SCHEMBL6888621 0.78 TACR1 (0.58)
SCHEMBL8829867 0.78 TACR1 (0.58)
SCHEMBL8829871 0.78 TACR1 (0.58)
SCHEMBL9293690 0.78 ACE (0.48)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0405537-B1 N-substituted cycloalkyl and polycycloalkyl alpha-substituted Trp-Phe- and phenethylamine derivatives WARNER LAMBERT CO (US) 2004-09-08 EP claimed