SCHEMBL8543004

SCHEMBL8543004

O=C1CCCC(c2cccc3ccccc23)N1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.48
IDO1 P14902 1/20 0.48
SMN1; SMN2 Q16637 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
PLA2G6 O60733 4/20 0.41
ALDH1A1 P00352 4/20 0.41
MAPK1 P28482 3/20 0.41
HPGD P15428 3/20 0.41
MAPT P10636 3/20 0.41
BLM P54132 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
PKM P14618 2/20 0.41
FAAH O00519 1/20 0.41
NPC1 O15118 1/20 0.41
GMNN O75496 1/20 0.41
LMNA P02545 1/20 0.41
MTOR P42345 1/20 0.41
RAB9A P51151 1/20 0.41
TRPC5 Q9UL62 1/20 0.41

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
SCHEMBL8544148 0.95 MTNR1A (0.47) MTNR1AIDO1SMN1; SMN2MEN1KMT2A
SCHEMBL5083830 0.82 IDO1 (0.58) MTNR1AIDO1SMN1; SMN2MEN1KMT2A
SCHEMBL18150964 0.74 L3MBTL1 (0.51) MEN1KMT2APKML3MBTL1ATM
SCHEMBL8768310 0.74 IDO1 (0.43) MTNR1AIDO1SMN1; SMN2MEN1KMT2A
SCHEMBL4149119 0.73 SCN9A (0.46) MTNR1AIDO1MEN1KMT2AKDM1A
SCHEMBL29144902 0.73 MTNR1A (0.45) MTNR1AIDO1SMN1; SMN2MEN1KMT2A
SCHEMBL16344586 0.73 MEN1 (0.42) SMN1; SMN2MEN1KMT2AALDH1A1HPGD
SCHEMBL1274980 0.73 DDB1 (0.44) SMN1; SMN2HPGD
SCHEMBL4802338 0.72 IDO1 (0.51) MTNR1AIDO1SMN1; SMN2PLA2G6ALDH1A1
SCHEMBL9634176 0.72 KDM1A (0.43) MTNR1AIDO1SMN1; SMN2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0792343-A1 USE OF BLEACH ACTIVATORS FOR LOW PERHYDROXYL CONCENTRATIONS THE PROCTER & GAMBLE COMPANY (US) 1997-09-03 EP claimed
US-5635104-A Bleaching solutions and method utilizing selected bleach activators effective at low perhydroxyl concentrations THE PROCTER & GAMBLE COMPANY (US) 1997-06-03 US claimed
WO-1996016156-A1 USE OF BLEACH ACTIVATORS FOR LOW PERHYDROXYL CONCENTRATIONS THE PROCTER & GAMBLE COMPANY (US) 1996-05-30 WO claimed
US-5753138-A COMPRISING SPECIFIED BLEACH ACTIVATOR PRODUCING PERACID ON HYDROLYSIS, HYDROGEN PEROXIDE SOURCE THE PROCTER & GAMBLE COMPANY (US) 1998-05-19 US disclosed
EP-0792345-A1 BLEACHING COMPOSITIONS AND BLEACH-ADDITIVES COMPRISING BLEACH ACTIVATORS EFFECTIVE AT LOW PERHYDROXYL CONCENTRATIONS THE PROCTER & GAMBLE COMPANY (US) 1997-09-03 EP disclosed
EP-0792343-A1 USE OF BLEACH ACTIVATORS FOR LOW PERHYDROXYL CONCENTRATIONS THE PROCTER & GAMBLE COMPANY (US) 1997-09-03 EP disclosed
EP-0792344-A1 BLEACHING DETERGENT COMPOSITIONS COMPRISING BLEACH ACTIVATORS EFFECTIVE AT LOW PERHYDROXYL CONCENTRATIONS THE PROCTER & GAMBLE COMPANY (US) 1997-09-03 EP disclosed
US-5635104-A Bleaching solutions and method utilizing selected bleach activators effective at low perhydroxyl concentrations THE PROCTER & GAMBLE COMPANY (US) 1997-06-03 US disclosed
WO-1996016155-A1 BLEACHING COMPOSITIONS AND BLEACH-ADDITIVES COMPRISING BLEACH ACTIVATORS EFFECTIVE AT LOW PERHYDROXYL CONCENTRATIONS THE PROCTER & GAMBLE COMPANY (US) 1996-05-30 WO disclosed
WO-1996016157-A1 BLEACHING DETERGENT COMPOSITIONS COMPRISING BLEACH ACTIVATORS EFFECTIVE AT LOW PERHYDROXYL CONCENTRATIONS THE PROCTER & GAMBLE COMPANY (US) 1996-05-30 WO disclosed
WO-1996016156-A1 USE OF BLEACH ACTIVATORS FOR LOW PERHYDROXYL CONCENTRATIONS THE PROCTER & GAMBLE COMPANY (US) 1996-05-30 WO disclosed