SCHEMBL27465233

SCHEMBL27465233

CC(=O)Oc1nccc(C)c1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 1/20 0.41
NOS2 P35228 1/20 0.41
LMNA P02545 3/20 0.39
POLB P06746 1/20 0.39
PTPN1 P18031 2/20 0.39
SSTR4 P31391 1/20 0.39
KDM4E B2RXH2 4/20 0.36
HSD17B10 Q99714 2/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
ACHE P22303 3/20 0.35
ALOX5 P09917 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HTT P42858 2/20 0.34
CYP3A4 P08684 2/20 0.34
TP53 P04637 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
ABCB11 O95342 1/20 0.34
ESR1 P03372 1/20 0.34

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
SCHEMBL28042298 0.83 LMNA (0.38) NOS3NOS2LMNAPOLBPTPN1
SCHEMBL28938844 0.81 LMNA (0.37) LMNAPOLBPTPN1KDM4EHSD17B10
SCHEMBL1135203 0.80 LMNA (0.40) LMNAPOLBPTPN1KDM4EHSD17B10
SCHEMBL27834382 0.79 SSTR4 (0.38) NOS3NOS2LMNAPOLBSSTR4
SCHEMBL4945110 0.77 KDM4E (0.44) NOS3NOS2LMNAPOLBPTPN1
SCHEMBL27586412 0.76 TDP1 (0.42) LMNAPOLBKDM4EALDH1A1HPGD
SCHEMBL27887045 0.74 LMNA (0.39) LMNAPOLBPTPN1SSTR4KDM4E
SCHEMBL6792963 0.73 NOS3 (0.48) NOS3NOS2SSTR4ALDH1A1GAA
SCHEMBL5802398 0.70 SSTR4 (0.40) NOS3NOS2SSTR4SMN1; SMN2TDP1
SCHEMBL1834615 0.70 KDM4E (0.39) LMNAPTPN1KDM4EHSD17B10ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1227347-C Bleach and oxidation catalyst UNILEVER PLC (NL) 2005-11-16 CN disclosed
CN-1167785-C Bleaching compositions and methods for bleaching substrates 2004-09-22 CN disclosed
CN-1163578-C Detergent bleaching composition 2004-08-25 CN disclosed
CN-1158263-C Method of treating a textile 2004-07-21 CN disclosed
CN-1325437-A Detergent bleaching compositions UNILEVER PLC (NL) 2001-12-05 CN disclosed
CN-1325436-A Bleaching and oxidation catalyst UNILEVER PLC (NL) 2001-12-05 CN disclosed
CN-1325435-A Bleaching compositions and methods for bleaching substrates UNILEVER PLC (NL) 2001-12-05 CN disclosed