SCHEMBL8788786

SCHEMBL8788786

O=C(O)CCNC(=O)[C@H]1CCCN1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PRCP P42785 3/20 0.60
HTR2C P28335 4/20 0.46
HTR2B P41595 2/20 0.46
KDM4E B2RXH2 1/20 0.43
TLR2 O60603 2/20 0.41
TERT O14746 1/20 0.41
ITGB3 P05106 5/20 0.40
ITGA2B P08514 5/20 0.40
F2R P25116 4/20 0.40
DPP7 Q9UHL4 1/20 0.40
CTSC P53634 1/20 0.40

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
SCHEMBL29758903 1.00 PRCP (0.60) PRCPHTR2CHTR2BKDM4ETLR2
SCHEMBL27702100 0.95 PRCP (0.55) PRCPHTR2CHTR2BKDM4ETLR2
SCHEMBL1705576 0.90 PRCP (0.66) PRCPHTR2CHTR2BKDM4ETLR2
SCHEMBL15329272 0.87 PRCP (0.70) PRCPHTR2CHTR2BKDM4ETLR2
SCHEMBL11587198 0.85 PRCP (0.59) PRCPHTR2CHTR2BKDM4ETLR2
Hydrochloric Acid SCHEMBL11585126 0.83 PRCP (0.57) PRCPHTR2CHTR2BKDM4ETLR2
SCHEMBL4578345 0.82 PRCP (0.64) PRCPHTR2CHTR2BKDM4ETLR2
SCHEMBL5097625 0.82 PRCP (0.64) PRCPHTR2CHTR2BKDM4ETLR2
SCHEMBL21582234 0.82 PRCP (0.64) PRCPHTR2CHTR2BKDM4ETLR2
SCHEMBL4578350 0.82 PRCP (0.64) PRCPHTR2CHTR2BKDM4ETLR2

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-0626942-B1 BICYCLO[2.2.2.]OCTANE DERIVATIVES AS CHOLESTOCYSTOKININ INHIBITORS BLACK JAMES FOUNDATION (GB) 1997-04-23 EP disclosed
US-5514683-A LIGANDS FKOR CHOLECYSTOKININ OR GASTRIN RECEPTORS JAMES BLACK FOUNDATION LIMITED (GB) 1996-05-07 US disclosed
EP-0626942-A1 BICYCLO 2.2.2.]OCTANE DERIVATIVES AS CHOLESTOCYSTOKININ INHIBITORS. BLACK JAMES FOUNDATION (GB) 1994-12-07 EP disclosed
WO-1993016982-A1 BICYCLO[2.2.2.]OCTANE DERIVATIVES AS CHOLESTOCYSTOKININ INHIBITORS JAMES BLACK FOUNDATION LIMITED (GB) 1993-09-02 WO disclosed