SCHEMBL3280122

SCHEMBL3280122

CCCCCCOC(=N)C(C)C(N)=O

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.47
EPHX1 P07099 2/20 0.44
TSHR P16473 3/20 0.43
HTR2C P28335 1/20 0.42
PRSS1 P07477 1/20 0.42
PRSS2 P07478 1/20 0.42
PRSS3 P35030 1/20 0.42
HCAR2 Q8TDS4 1/20 0.41
RAD52 P43351 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ALDH1A1 P00352 2/20 0.41
NPC1 O15118 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
FAAH O00519 1/20 0.40
LMNA P02545 1/20 0.40
ACHE P22303 2/20 0.40

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
SCHEMBL3280038 0.93 ALDH1A1 (0.45) NAAAEPHX1TSHRHCAR2NPSR1
SCHEMBL3281726 0.85 HCAR2 (0.34) EPHX1TSHRHCAR2ALDH1A1LMNA
SCHEMBL3287229 0.81 NAAA (0.46) NAAAEPHX1TSHRHTR2CPRSS1
Guanidine SCHEMBL9055320 0.77 NAAA (0.48) NAAAEPHX1TSHRHTR2CPRSS1
SCHEMBL26925138 0.75 NAAA (0.59) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL27889739 0.75 NAAA (0.59) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL26922989 0.75 NAAA (0.59) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL26923837 0.75 NAAA (0.59) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL26924856 0.75 NAAA (0.59) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL26922817 0.75 NAAA (0.59) NAAAEPHX1TSHRHCAR2RAD52

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1840118-B1 METHOD FOR PRODUCING IMIDE ETHER COMPOUND NIPPOH CHEMICALS (JP) 2016-04-20 EP disclosed
US-7705175-B2 Method for producing imide ether compound NIPPOH CHEMICALS CO., LTD. (JP) 2010-04-27 US disclosed
US-20090005599-A1 Method for Producing Imide Ether Compound NIPPOH CHEMICALS CO., LTD. (JP) 2009-01-01 US disclosed
EP-1840118-A1 METHOD FOR PRODUCING IMIDE ETHER COMPOUND Nippoh Chemicals Co., Ltd (JP) 2007-10-03 EP disclosed