SCHEMBL5383065

SCHEMBL5383065

COC(=O)c1cn(Cc2cc(OCc3ccccc3)cc(OCc3ccccc3)c2)cc1-c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
LMNA P02545 1/20 0.43
HPGD P15428 1/20 0.43
CNR1 P21554 1/20 0.41
GSTP1 P09211 2/20 0.40
GABRA1 P14867 2/20 0.40
GABRG2 P18507 2/20 0.40
GABRB3 P28472 2/20 0.40
GABRA3 P34903 2/20 0.40
MAOB P27338 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
P2RY14 Q15391 1/20 0.40
S1PR5 Q9H228 2/20 0.40
S1PR1 P21453 1/20 0.40
HIF1A Q16665 1/20 0.39
GBA1 P04062 1/20 0.39
GABRA5 P31644 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
SCHEMBL5385365 0.90 S1PR5 (0.51) MEN1KMT2AGSTP1MAOBSMN1; SMN2
SCHEMBL7491027 0.89 MEN1 (0.51) MEN1KMT2AGSTP1SMN1; SMN2P2RY14
SCHEMBL5382479 0.87 P2RY14 (0.47) MEN1KMT2AHPGDCNR1GSTP1
SCHEMBL7539595 0.80 MAOB (0.47) MEN1KMT2AGSTP1MAOB
SCHEMBL5382756 0.79 MEN1 (0.43) MEN1KMT2ALMNAGSTP1MAOB
SCHEMBL5393626 0.78 GSTP1 (0.45) MEN1KMT2AGSTP1MAOBNPC1
SCHEMBL5377296 0.78 PTGER3 (0.51) MEN1KMT2ALMNAGSTP1P2RY14
SCHEMBL5377289 0.78 PTGER3 (0.51) MEN1KMT2ALMNAGSTP1P2RY14
SCHEMBL5377062 0.77 LTB4R (0.46) MEN1KMT2AGSTP1P2RY14PPARG
SCHEMBL4460274 0.76 MAOB (0.57) MEN1KMT2ALMNAHPGDGSTP1

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
US-7179823-B1 5-membered n-heterocyclic compounds with hypoglycemic and hypolipidemic activity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-02-20 US disclosed
EP-1457490-A1 5-membered N-heterocyclic compounds with hypoglycemic and hypolipidemic activity Takeda Chemical Industries, Ltd. (JP) 2004-09-15 EP disclosed
EP-1228067-B1 5-MEMBERED N-HETEROCYCLIC COMPOUNDS WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2004-07-14 EP disclosed