SCHEMBL6159764

SCHEMBL6159764

O=C(O)c1nc(C2CC3C=CC2C3)[nH]c1CCC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.46

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.39

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
SCHEMBL6159724 0.86 EPHX2 (0.35) EPHX2
SCHEMBL6160311 0.84 EPHX2 (0.38) EPHX2
SCHEMBL6160058 0.83 CCKBR (0.47) EPHX2
SCHEMBL6160599 0.83 CCKBR (0.47) EPHX2
SCHEMBL6160565 0.83 CCKBR (0.47) EPHX2
SCHEMBL6162281 0.81
SCHEMBL6158657 0.76 CCKBR (0.47)
Formic Acid SCHEMBL7535336 0.74 EPHX2 (0.37) EPHX2
SCHEMBL6160385 0.71 CYP1A2 (0.48)
SCHEMBL6158115 0.70 CCKBR (0.43) EPHX2

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-1178969-B1 GASTRIN AND CHOLECYSTOKININ RECEPTOR LIGANDS BLACK JAMES FOUNDATION (GB) 2005-07-13 EP disclosed
US-6479531-B1 Gastrin and cholecystokinin receptor ligands JAMES BLACK FOUNDATION LIMITED (GB) 2002-11-12 US disclosed
EP-1178969-A1 GASTRIN AND CHOLECYSTOKININ RECEPTOR LIGANDS JAMES BLACK FOUNDATION LIMITED (GB) 2002-02-13 EP disclosed
WO-2000027823-A1 GASTRIN AND CHOLECYSTOKININ RECEPTOR LIGANDS JAMES BLACK FOUNDATION LIMITED (GB) 2000-05-18 WO disclosed