SCHEMBL8199082

SCHEMBL8199082

CC(C)(C)OC(=O)NCCc1cc(Cl)cc(C(=O)c2ccccc2)c1N

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 1/20 0.44
IDO1 P14902 4/20 0.43
LMNA P02545 2/20 0.42
MEN1 O00255 1/20 0.41
TSHR P16473 1/20 0.41
KMT2A Q03164 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
SCHEMBL8198955 0.94 BRD4 (0.40) NQO2IDO1
SCHEMBL8206463 0.89 KCNA5 (0.43)
SCHEMBL8211311 0.84 LMNA (0.45) NQO2IDO1LMNAMEN1TSHR
SCHEMBL8198952 0.79 SYK (0.39) LMNAMEN1KMT2A
SCHEMBL8197856 0.79 MAPT (0.45) LMNA
SCHEMBL8197947 0.78 IDO1 (0.41) NQO2IDO1LMNAMEN1TSHR
SCHEMBL6189525 0.77 CA1 (0.45) IDO1LMNAMEN1TSHRKMT2A
SCHEMBL6189844 0.77 RECQL (0.48) NQO2IDO1LMNAMEN1TSHR
SCHEMBL27536806 0.77 SLC7A5 (0.41)
SCHEMBL27536876 0.77 GABRP (0.44)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1252795-A 4, 1-benzoxazepine *, their analogs and their use as somatostatin agonists TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2000-05-10 CN disclosed
EP-0979227-A1 4,1-BENZOXAZEPINES, THEIR ANALOGUES, AND THEIR USE AS SOMATOSTATIN AGONISTS Takeda Chemical Industries, Ltd. (JP) 2000-02-16 EP disclosed
WO-1998047882-A1 4,1-BENZOXAZEPINES, THEIR ANALOGUES, AND THEIR USE AS SOMATOSTATIN AGONISTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-10-29 WO disclosed