SCHEMBL9338573

SCHEMBL9338573

CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1CCCCC1Cl)C(=O)NC(CO)Cc1ccccc1

nearest known ligand 0.73

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 1/20 0.55

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
SCHEMBL8829919 0.92
SCHEMBL6888076 0.91 TACR1 (0.54) CCKBR
SCHEMBL6888430 0.84 CCKBR (0.69) CCKBR
SCHEMBL6888433 0.84 CCKBR (0.69) CCKBR
SCHEMBL6888428 0.84 CCKBR (0.69) CCKBR
SCHEMBL7047252 0.82 CCKBR (0.44) CCKBR
SCHEMBL9335086 0.82 TACR1 (0.56) CCKBR
SCHEMBL6892529 0.82 TACR1 (0.54) CCKBR
SCHEMBL6888621 0.82 TACR1 (0.58)
SCHEMBL8829871 0.82 TACR1 (0.58)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1993003721-A1 CHOLECYSTOKININ ANTAGONISTS USEFUL FOR TREATING DEPRESSION WARNER-LAMBERT COMPANY (US) 1993-03-04 WO claimed
EP-0405537-A1 N-substituted cycloalkyl and polycycloalkyl alpha-substituted Trp-Phe- and phenethylamine derivatives WARNER-LAMBERT COMPANY (US) 1991-01-02 EP claimed
EP-0594692-A1 CHOLECYSTOKININ ANTAGONISTS USEFUL IN THE TREATMENT OF PANIC ATTACKS WARNER-LAMBERT COMPANY (US) 1994-05-04 EP disclosed
WO-1993003721-A1 CHOLECYSTOKININ ANTAGONISTS USEFUL FOR TREATING DEPRESSION WARNER-LAMBERT COMPANY (US) 1993-03-04 WO disclosed
WO-1993000897-A1 CHOLECYSTOKININ ANTAGONISTS USEFUL IN THE TREATMENT OF PANIC ATTACKS WARNER-LAMBERT COMPANY (US) 1993-01-21 WO disclosed