SCHEMBL8618484

SCHEMBL8618484

O=C(NC1C(=O)N(CCC2CCCC2)c2ccccc2N(c2ccccc2F)C1=O)Oc1ccccc1

nearest known ligand 0.73

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 17/20 0.73
CCKAR P32238 2/20 0.49
ALDH1A1 P00352 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL8619104 0.85 CCKBR (0.71) CCKBRCCKAR
SCHEMBL8621037 0.83 CCKBR (0.71) CCKBR
SCHEMBL8639174 0.78 CCKBR (1.00) CCKBRCCKAR
SCHEMBL8540648 0.76 CCKBR (0.63) CCKBRCCKAR
SCHEMBL8617171 0.74 CCKBR (0.72) CCKBR
SCHEMBL8617342 0.73 CCKBR (0.70) CCKBRCCKAR
SCHEMBL8615099 0.73 CCKBR (0.56) CCKBRCCKAR
SCHEMBL8616191 0.73 CCKBR (0.85) CCKBR
SCHEMBL8547385 0.72 CCKBR (0.70) CCKBRCCKAR
SCHEMBL8618163 0.71 CCKBR (0.70) CCKBR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0623118-B1 CARBAMATE DERIVATIVES AND THEIR USE IN MEDICINE GLAXO WELLCOME SPA (IT) 1998-05-13 EP disclosed
US-5486514-A GASTRIN, CHOLECYSTOKININ RECEPTOR ANTAGONISTS GLAXO SPA (IT) 1996-01-23 US disclosed