SCHEMBL3811564

SCHEMBL3811564

O=C(NCCOc1ccccc1)OCc1ccccc1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.80
MAPT P10636 1/20 0.80
SMN1; SMN2 Q16637 3/20 0.74
LMNA P02545 1/20 0.74
HTT P42858 1/20 0.61
MTNR1A P48039 1/20 0.59
MTNR1B P49286 1/20 0.59
RAB9A P51151 3/20 0.58
NPC1 O15118 2/20 0.58
HPGD P15428 1/20 0.58
TGM2 P21980 1/20 0.55
KEAP1 Q14145 2/20 0.53
NFE2L2 Q16236 2/20 0.53
RECQL P46063 2/20 0.51
HTR1A P08908 1/20 0.51
ADRA1D P25100 1/20 0.51
ADRA1A P35348 1/20 0.51
ADRA1B P35368 1/20 0.51
TSHR P16473 1/20 0.51
TAAR1 Q96RJ0 1/20 0.51

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
SCHEMBL3154782 0.90 L3MBTL1 (0.70) L3MBTL1MAPTSMN1; SMN2LMNAHTT
SCHEMBL20299180 0.90 L3MBTL1 (0.79) L3MBTL1MAPTSMN1; SMN2LMNAHTT
SCHEMBL20500014 0.90 L3MBTL1 (0.74) L3MBTL1MAPTSMN1; SMN2LMNAHTT
SCHEMBL30288350 0.89 L3MBTL1 (0.77) L3MBTL1MAPTSMN1; SMN2LMNAHTT
SCHEMBL16858391 0.89 L3MBTL1 (0.65) L3MBTL1MAPTSMN1; SMN2LMNAHTT
SCHEMBL9272300 0.89 L3MBTL1 (0.81) L3MBTL1MAPTSMN1; SMN2LMNAHTT
SCHEMBL4837972 0.89 L3MBTL1 (0.77) L3MBTL1MAPTSMN1; SMN2LMNAHTT
SCHEMBL30829569 0.88 L3MBTL1 (0.64) L3MBTL1MAPTSMN1; SMN2LMNAHTT
SCHEMBL6331080 0.88 L3MBTL1 (0.71) L3MBTL1MAPTSMN1; SMN2LMNAHTT
SCHEMBL30829561 0.88 L3MBTL1 (0.64) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1885695-B8 INDOLINE COMPOUNDS FOURNIER LAB SA (FR) 2009-08-12 EP disclosed
EP-1885695-B1 INDOLINE COMPOUNDS FOURNIER LAB SA (FR) 2009-02-25 EP disclosed
EP-1885695-A2 NOVEL INDOLINE COMPOUNDS LABORATOIRES FOURNIER S.A. (FR) 2008-02-13 EP disclosed
WO-2007000550-A2 NOVEL INDOLINE COMPOUNDS LABORATOIRES FOURNIER S.A. (FR) 2007-01-04 WO disclosed