SCHEMBL9205258

SCHEMBL9205258

CC(=O)c1ccc(OCCNC(=O)OCc2ccccc2)cc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.75
MAPT P10636 2/20 0.75
MAOB P27338 1/20 0.63
SMN1; SMN2 Q16637 3/20 0.62
LMNA P02545 1/20 0.62
HTT P42858 2/20 0.54
ALDH1A1 P00352 1/20 0.54
MTNR1A P48039 1/20 0.54
MTNR1B P49286 1/20 0.54
USP2 O75604 1/20 0.53
ALOX15 P16050 1/20 0.53
TSHR P16473 1/20 0.53
MAPK1 P28482 1/20 0.53
HSD17B10 Q99714 1/20 0.53
GAA P10253 1/20 0.50
ITGB3 P05106 1/20 0.49
ITGA2B P08514 1/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
MEN1 O00255 2/20 0.49

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
SCHEMBL20500014 0.90 L3MBTL1 (0.74) L3MBTL1MAPTSMN1; SMN2LMNAHTT
SCHEMBL7732296 0.88 L3MBTL1 (0.60) L3MBTL1MAPTMAOBSMN1; SMN2LMNA
SCHEMBL9272300 0.88 L3MBTL1 (0.81) L3MBTL1MAPTSMN1; SMN2LMNAHTT
SCHEMBL3811564 0.88 L3MBTL1 (0.80) L3MBTL1MAPTSMN1; SMN2LMNAHTT
SCHEMBL6331080 0.87 L3MBTL1 (0.71) L3MBTL1MAPTSMN1; SMN2LMNAHTT
SCHEMBL20008740 0.87 L3MBTL1 (0.71) L3MBTL1MAPTSMN1; SMN2LMNAHTT
SCHEMBL24627827 0.86 L3MBTL1 (0.70) L3MBTL1MAPTMAOBSMN1; SMN2LMNA
SCHEMBL28677911 0.86 MAPT (0.78) L3MBTL1MAPTSMN1; SMN2LMNAHTT
SCHEMBL4839180 0.84 MAPT (0.71) L3MBTL1MAPTSMN1; SMN2LMNAHTT
SCHEMBL20299180 0.84 L3MBTL1 (0.79) L3MBTL1MAPTSMN1; SMN2LMNAHTT

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-0389437-B1 Luciferin derivatives NIPPON ZOKI PHARMACEUTICAL CO (JP) 1995-05-24 EP disclosed
US-5128069-A Luciferin derivatives NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) 1992-07-07 US disclosed
EP-0389437-A1 Luciferin derivatives NIPPON ZOKI PHARMACEUTICAL CO. LTD. (JP) 1990-09-26 EP disclosed