SCHEMBL7484752

SCHEMBL7484752

COC(=O)[C@H]1COc2cc(CC(C)=O)ccc2O1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.49
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.46
NPC1 O15118 5/20 0.46
RAB9A P51151 4/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
TSHR P16473 3/20 0.42
KMT2A Q03164 2/20 0.42
CYP3A4 P08684 1/20 0.42
MAPT P10636 2/20 0.41
ALOX15 P16050 1/20 0.41
HSD17B10 Q99714 1/20 0.41
GAA P10253 1/20 0.41
HTT P42858 1/20 0.40
L3MBTL1 Q9Y468 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
SCHEMBL7489974 1.00 HPGD (0.49) HPGDALDH1A1KDM4ENPC1RAB9A
SCHEMBL7484765 1.00 HPGD (0.49) HPGDALDH1A1KDM4ENPC1RAB9A
SCHEMBL7483826 0.87 CYP4F2 (0.51) HPGDALDH1A1RAB9ATSHRKMT2A
SCHEMBL7490164 0.87 CYP4F2 (0.51) HPGDALDH1A1RAB9ATSHRKMT2A
SCHEMBL7483813 0.87 CYP4F2 (0.51) HPGDALDH1A1RAB9ATSHRKMT2A
SCHEMBL7488184 0.82 CYP4F2 (0.51) HPGDALDH1A1KDM4ERAB9ASMN1; SMN2
SCHEMBL27719180 0.79 L3MBTL1 (0.46) HPGDALDH1A1KDM4ENPC1RAB9A
SCHEMBL4625575 0.78 HPGD (0.52) HPGDALDH1A1KDM4ENPC1RAB9A
SCHEMBL7487013 0.76 MAPT (0.48) HPGDALDH1A1KDM4ENPC1RAB9A
SCHEMBL7485154 0.76 MAPT (0.48) HPGDALDH1A1KDM4ENPC1RAB9A

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
EP-0825189-B1 1,4-BENZODIOXIN DERIVATIVES NISSHIN PHARMA INC (JP) 2002-01-02 EP disclosed
US-6130243-A PROPHYLACTIC OR THERAPEUTIC AGENT FOR DIABETES, HYPERGLYCEMIA AND OBESITY IN MAMMALS NISSHIN FLOUR MILLING CO., LTD. (JP) 2000-10-10 US disclosed
EP-0825189-A1 1,4-BENZODIOXIN DERIVATIVES NISSHIN FLOUR MILLING CO., LTD. (JP) 1998-02-25 EP disclosed