SCHEMBL8209850

SCHEMBL8209850

CCOC(=O)CC1=CN=Cc2ccccc2O1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
PKM P14618 1/20 0.39
POLB P06746 2/20 0.39
ALDH1A1 P00352 3/20 0.39
HSD17B10 Q99714 1/20 0.39
TSHR P16473 2/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.36
TRPM8 Q7Z2W7 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL9933270 0.77 TRPA1 (0.43) SMN1; SMN2HSD17B10LMNAHTTMAPK1
SCHEMBL27490082 0.71 RECQL (0.41) RECQLSMN1; SMN2PKMPOLBALDH1A1
SCHEMBL10499941 0.67 TRPA1 (0.40)
SCHEMBL6188489 0.67 SMN1; SMN2 (0.41) RECQLSMN1; SMN2PKMPOLBALDH1A1
SCHEMBL68340 0.64 PKM (0.60) SMN1; SMN2PKMALDH1A1HSD17B10TSHR
SCHEMBL9692782 0.64 ALOX5 (0.40) RECQLSMN1; SMN2PKMPOLBALDH1A1
SCHEMBL4818941 0.63 MEN1 (0.61) POLBALDH1A1LMNA
SCHEMBL27490774 0.63 POLB (0.60) SMN1; SMN2POLBTSHRLMNAMAPK1
SCHEMBL112999 0.63 ALDH1A1 (0.68) SMN1; SMN2PKMALDH1A1TSHRLMNA
SCHEMBL1332625 0.63 ALDH1A1 (0.68) SMN1; SMN2PKMALDH1A1TSHRLMNA

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-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
EP-0862562-A1 BENZOXAZEPINE COMPOUNDS, THEIR PRODUCTION AND USE AS LIPID LOWERING AGENTS Takeda Chemical Industries, Ltd. (JP) 1998-09-09 EP disclosed
WO-1997010224-A1 BENZOXAZEPINE COMPOUNDS, THEIR PRODUCTION AND USE AS LIPID LOWERING AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-03-20 WO disclosed