SCHEMBL4079495

SCHEMBL4079495

C=C(C(N)=O)C1CCCCCCCCCCC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.48
CES1 P23141 1/20 0.48
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
NOS2 P35228 2/20 0.40
EPHX1 P07099 3/20 0.39
TSHR P16473 2/20 0.39
ALDH1A1 P00352 1/20 0.39
MGLL Q99685 1/20 0.37
HSD11B1 P28845 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
ATM Q13315 1/20 0.35
CYP2D6 P10635 1/20 0.35
RECQL P46063 1/20 0.34
ALOX5 P09917 1/20 0.34
SRD5A2 P31213 1/20 0.34
TDP1 Q9NUW8 1/20 0.33
HSD11B2 P80365 1/20 0.33

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
SCHEMBL3114031 1.00 CES2 (0.48) CES2CES1HDAC8HDAC6NOS2
SCHEMBL163416 1.00 CES2 (0.48) CES2CES1HDAC8HDAC6NOS2
SCHEMBL532571 0.97 CES2 (0.43) CES2CES1HDAC8HDAC6NOS2
SCHEMBL4743865 0.92
SCHEMBL730807 0.87 TDP1 (0.38) NOS2KDM4EMAPTKMT2AATM
SCHEMBL543402 0.87
SCHEMBL761934 0.79 CES2 (0.52) CES2CES1HDAC8HDAC6EPHX1
SCHEMBL6360577 0.78 EPHX2 (0.34) NOS2TDP1
SCHEMBL20272049 0.78 TDP1 (0.32) NOS2TDP1
Propane SCHEMBL28407353 0.78 SMN1; SMN2 (0.38) NOS2KMT2ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7500895-B2 Patterned substrate, electro-optical device, and method for manufacturing an electro-optical device SEIKO EPSON CORPORATION (JP) 2009-03-10 US disclosed
US-20060127563-A1 Patterned substrate, electro-optical device, and method for manufacturing an electro-optical device SEIKO EPSON CORPORATION (JP) 2006-06-15 US disclosed
US-20050287392-A1 Organic electroluminescent device, method for producing the same, and electronic apparatus SEIKO EPSON CORPORATION (JP) 2005-12-29 US disclosed