SCHEMBL1574511

SCHEMBL1574511

Cc1ccc(C2=N[C@H](NC(=O)OCc3ccccc3)C(=O)N(CC(=O)C(C)(C)C)c3ccccc32)cc1

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SENP1 Q9P0U3 3/20 0.68
BRD4 O60885 5/20 0.63
BRD2 P25440 5/20 0.63
BRD3 Q15059 5/20 0.63
CCKAR P32238 2/20 0.62
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
SCHEMBL1574507 1.00 SENP1 (0.68) SENP1BRD4BRD2BRD3CCKAR
SCHEMBL1574340 0.95 SENP1 (0.75) SENP1BRD4BRD2BRD3CCKAR
SCHEMBL1574343 0.95 SENP1 (0.75) SENP1BRD4BRD2BRD3CCKAR
SCHEMBL8556281 0.88 SENP1 (0.59) SENP1BRD4BRD2BRD3CCKAR
SCHEMBL6934495 0.87 SENP1 (0.72) SENP1BRD4BRD2BRD3CCKAR
SCHEMBL1574324 0.85 BRD4 (0.63) SENP1BRD4BRD2BRD3CCKAR
SCHEMBL1574321 0.85 BRD4 (0.63) SENP1BRD4BRD2BRD3CCKAR
SCHEMBL8939417 0.85 SENP1 (0.79) SENP1BRD4BRD2BRD3CCKAR
SCHEMBL8711261 0.85 SENP1 (0.79) SENP1BRD4BRD2BRD3CCKAR
SCHEMBL8711263 0.85 SENP1 (0.79) SENP1BRD4BRD2BRD3CCKAR

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-1342719-B1 Benzodiazepine derivatives useful as CCK-Receptor Antagonists FERRING BV (NL) 2011-04-13 EP disclosed
US-5962451-A GASTROINTESTINAL DISORDERS; ANTIULCER AGENT; ANTICANCER AGENTS; SIDE-EFFECT REDUCTION FERRING BV (NL) 1999-10-05 US disclosed
US-5688943-A CHOLECYSTOKININ ANTAGONIST; ANTIULCER AGENTS; PSYCHOLOGICAL DRUGS; ANXIOLYTIC AGENTS; CONTROLLING APPETITE YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1997-11-18 US disclosed
WO-1993016999-A1 BENZODIAZEPIN DERIVATIVES USEFUL AS CCK-RECEPTOR ANTAGONISTS YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1993-09-02 WO disclosed