SCHEMBL1715918

SCHEMBL1715918

O=C(O)c1ccccc1N1CCCCCC1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.71
PTPN1 P18031 2/20 0.61
L3MBTL1 Q9Y468 3/20 0.56
GAA P10253 1/20 0.56
ALDH1A1 P00352 5/20 0.54
ALOX15 P16050 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
KDM4E B2RXH2 2/20 0.52
POLB P06746 1/20 0.52
ATM Q13315 2/20 0.51
HTT P42858 2/20 0.51
USP2 O75604 1/20 0.51
GLA P06280 1/20 0.51
TSHR P16473 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
MYC P01106 3/20 0.50
KEAP1 Q14145 1/20 0.50
NR4A1 P22736 1/20 0.50
MAPK1 P28482 1/20 0.48
ENPP2 Q13822 1/20 0.48

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
SCHEMBL227731 1.00 NPC1 (0.71) NPC1PTPN1L3MBTL1GAAALDH1A1
SCHEMBL29467270 0.98 NPC1 (0.68) NPC1PTPN1L3MBTL1GAAALDH1A1
SCHEMBL2492855 0.98 NPC1 (0.68) NPC1PTPN1L3MBTL1GAAALDH1A1
SCHEMBL28771676 0.93 NPC1 (0.63) NPC1PTPN1L3MBTL1GAAALDH1A1
SCHEMBL8048603 0.90 ALDH1A1 (0.61) NPC1PTPN1L3MBTL1ALDH1A1ALOX15
SCHEMBL10607126 0.89 NPC1 (0.62) NPC1PTPN1L3MBTL1GAAALDH1A1
SCHEMBL28086833 0.84 NPC1 (0.70) NPC1PTPN1L3MBTL1GAAALDH1A1
SCHEMBL10684744 0.84 NPC1 (0.65) NPC1PTPN1L3MBTL1GAAALDH1A1
SCHEMBL605593 0.83 NPC1 (1.00) NPC1PTPN1L3MBTL1GAAALDH1A1
SCHEMBL3808106 0.83 ALDH1A1 (0.70) NPC1ALDH1A1ALOX15SMN1; SMN2POLB

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1880416-B1 PROCESS FOR MINIMIZING ELECTROMIGRATION IN AN ELECTRONIC DEVICE DOW CORNING (US) 2012-01-18 EP claimed
EP-1597332-B1 CONDUCTIVE ADHESIVE COMPOSITIONS WITH ELECTRICAL STABILITY AND GOOD IMPACT RESISTANCE FOR USE IN ELECTRONICS DEVICES NAT STARCH CHEM INVEST (US) 2008-05-07 EP claimed
CN-111943912-A Preparation method of 2-aminocinnamoyl alcohol ester derivative 华侨大学 2020-11-17 CN disclosed
EP-2035386-A1 ISOQUINOLINE DERIVATIVES AND THEIR USE AS INHIBITORS OF CYTOKINE MEDIATED DISEASES AstraZeneca AB (SE) 2009-03-18 EP disclosed
WO-2007149031-A1 ISOQUINOLINE DERIVATIVES AND THEIR USE AS INHIBITORS OF CYTOKINE MEDIATED DISEASES ASTRAZENECA AB (SE) 2007-12-27 WO disclosed