SCHEMBL818941

SCHEMBL818941

C=CC(=O)OCC(O)COc1ccc(-c2ccc(OCC(O)COC(=O)C=C)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.50
POLB P06746 2/20 0.49
MAPT P10636 2/20 0.49
LMNA P02545 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
THRB P10828 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.44
ALDH1A1 P00352 2/20 0.44
TSHR P16473 1/20 0.43
PKM P14618 1/20 0.41
HPGD P15428 1/20 0.40
CYP2D6 P10635 1/20 0.40
ADRB2 P07550 1/20 0.40
ADRB1 P08588 1/20 0.40
ADRB3 P13945 1/20 0.40
PLA2G4B P0C869 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
KDM1A O60341 1/20 0.39
MAOA P21397 1/20 0.39

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
SCHEMBL818977 0.94 THRB (0.52) CYP1A2POLBMAPTLMNANPSR1
SCHEMBL2128155 0.91 CYP1A2 (0.50) CYP1A2POLBMAPTLMNANPSR1
SCHEMBL14173310 0.91 CYP1A2 (0.50) CYP1A2POLBMAPTLMNANPSR1
SCHEMBL13806660 0.91 ALDH1A1 (0.55) CYP1A2MAPTSMN1; SMN2ALDH1A1HPGD
SCHEMBL13590413 0.89 PLA2G4B (0.44) CYP1A2POLBMAPTLMNANPSR1
SCHEMBL13816877 0.89 CYP1A2 (0.44) CYP1A2POLBMAPTLMNANPSR1
SCHEMBL14173321 0.88 CYP1A2 (0.48) CYP1A2POLBMAPTLMNANPSR1
SCHEMBL819190 0.88 CYP1A2 (0.48) CYP1A2POLBMAPTLMNANPSR1
SCHEMBL21436768 0.88 CYP1A2 (0.48) CYP1A2POLBMAPTLMNANPSR1
SCHEMBL10609343 0.88 CYP1A2 (0.48) CYP1A2POLBMAPTLMNANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180226605-A1 GAS BARRIER FILM, ORGANIC ELECTRONIC DEVICE, SUBSTRATE FOR ORGANIC ELECTROLUMINESCENCE DEVICE, AND ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2018-08-09 US disclosed
US-20180226605-A1 GAS BARRIER FILM, ORGANIC ELECTRONIC DEVICE, SUBSTRATE FOR ORGANIC ELECTROLUMINESCENCE DEVICE, AND ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2018-08-09 US disclosed
WO-2013083564-A1 COMPOSITIONS CONTAINING A VINYL ESTER RESIN THAT CAN BE USED TO OBTAIN MATERIALS HAVING AN OPTIMISED PERFORMANCE, AND MATERIALS OBTAINED FROM SAID COMPOSITIONS UNIVERSITE DE REIMS CHAMPAGNE-ARDENNE (FR) 2013-06-13 WO disclosed
WO-2013083567-A1 CURABLE COMPOSITIONS THAT CAN BE USED TO OBTAIN MATERIALS HAVING AN OPTIMISED PERFORMANCE, AND MATERIALS OBTAINED FROM SAID COMPOSITIONS ASTRIUM SAS (FR) 2013-06-13 WO disclosed
US-8283020-B2 Laminate film and composite film FUJIFILM CORPORATION (JP) 2012-10-09 US disclosed
US-8283020-B2 Laminate film and composite film FUJIFILM CORPORATION (JP) 2012-10-09 US disclosed
US-20110052868-A1 LAMINATE FILM AND COMPOSITE FILM FUJIFILM CORPORATION (JP) 2011-03-03 US disclosed
US-20110052868-A1 LAMINATE FILM AND COMPOSITE FILM FUJIFILM CORPORATION (JP) 2011-03-03 US disclosed
US-20090324970-A1 BARRIER LAMINATE, GAS BARRIER FILM, DEVICE AND METHOD FOR PRODUCING BARRIER LAMINATE FUJIFILM CORPORATION (JP) 2009-12-31 US disclosed
US-20090324970-A1 BARRIER LAMINATE, GAS BARRIER FILM, DEVICE AND METHOD FOR PRODUCING BARRIER LAMINATE FUJIFILM CORPORATION (JP) 2009-12-31 US disclosed