SCHEMBL2829189

SCHEMBL2829189

C=CCC(N)CC(N)OC(=O)c1cccc(C(=O)OC(N)CC(N)CC=C)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 3/20 0.35
LOXL2 Q9Y4K0 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
CYP2C19 P33261 1/20 0.33
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 1/20 0.33
ADRB2 P07550 1/20 0.33
ADRB1 P08588 1/20 0.33
ADRB3 P13945 1/20 0.33
FNTA P49354 1/20 0.33
FNTB P49356 1/20 0.33
PGGT1B P53609 1/20 0.33
TP53 P04637 1/20 0.33
TSHR P16473 1/20 0.33
ALDH1A1 P00352 1/20 0.32
ANPEP P15144 2/20 0.32
ENPEP Q07075 2/20 0.32
CYP3A4 P08684 1/20 0.31

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
SCHEMBL2801841 0.73 SLC7A5 (0.44) SLC7A5LOXL2SMN1; SMN2NPC1MAPT
SCHEMBL6281232 0.72 SMN1; SMN2 (0.38) SLC7A5LOXL2SMN1; SMN2CYP2C19NPC1
SCHEMBL4131445 0.72 GRIK1 (0.38) SMN1; SMN2MAPTTSHRALDH1A1CYP3A4
SCHEMBL959011 0.71 FFAR1 (0.38) SMN1; SMN2CYP2C19NPC1MAPTHTT
SCHEMBL2830559 0.71 SLC7A5 (0.36) SLC7A5LOXL2SMN1; SMN2NPC1MAPT
Isophthalic Acid SCHEMBL2829187 0.70 ANPEP (0.44) FNTAFNTBPGGT1BANPEPENPEP
SCHEMBL2596645 0.69 TSHR (0.58) SMN1; SMN2CYP2C19NPC1HTTRAB9A
SCHEMBL6281238 0.69 LMNA (0.38) SLC7A5SMN1; SMN2NPC1MAPTHTT
SCHEMBL25424122 0.68 DPP7 (0.39) SLC7A5LOXL2SMN1; SMN2NPC1MAPT
SCHEMBL3411837 0.68 DPP7 (0.39) SLC7A5LOXL2SMN1; SMN2NPC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE41585-E1 Method for controlling the rheology of an aqueous fluid and gelling agent therefor AKZO NOBEL NV 2010-08-24 US disclosed
EP-1042425-B1 A METHOD FOR CONTROLLING THE RHEOLOGY OF AN AQUEOUS FLUID AND GELLING AGENT THEREFOR AKZO NOBEL NV (NL) 2002-11-06 EP disclosed
US-6239183-B1 INJECTING VISCOELASTIC FLUID CONTAINING AMIDOAMINE OXIDE GELLING AGENT AND QUATERNARY AMMONIUM SALT OF AROMATIC DICARBOXYLIC ACID INTO SUBTERRANEAN FORMATION AKZO NOBEL NV (NL) 2001-05-29 US disclosed
EP-1042425-A1 A METHOD FOR CONTROLLING THE RHEOLOGY OF AN AQUEOUS FLUID AND GELLING AGENT THEREFOR Akzo Nobel N.V. (NL) 2000-10-11 EP disclosed
WO-1999032572-A1 A METHOD FOR CONTROLLING THE RHEOLOGY OF AN AQUEOUS FLUID AND GELLING AGENT THEREFOR AKZO NOBEL N.V. (NL) 1999-07-01 WO disclosed