SCHEMBL2830559

SCHEMBL2830559

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

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.36
LOXL2 Q9Y4K0 1/20 0.35
NPC1 O15118 2/20 0.34
MAPT P10636 2/20 0.34
RAB9A P51151 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
HTT P42858 1/20 0.34
ADRB2 P07550 1/20 0.34
ADRB1 P08588 1/20 0.34
ADRB3 P13945 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
LMNA P02545 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
CYP3A4 P08684 1/20 0.32
CYP4F2 P78329 1/20 0.32
CYP4A11 Q02928 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32

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 0.83 SLC7A5 (0.44) SLC7A5LOXL2NPC1MAPTRAB9A
Propylamine SCHEMBL2830556 0.79 KMT2A (0.44) LOXL2NPC1RAB9ASMN1; SMN2HTT
SCHEMBL587284 0.74 KMT2A (0.50) MAPTRAB9ASMN1; SMN2HTTMEN1
SCHEMBL7558137 0.72 TSHR (0.53) NPC1MAPTRAB9ASMN1; SMN2HTT
SCHEMBL7556822 0.72 TSHR (0.53) NPC1MAPTRAB9ASMN1; SMN2HTT
SCHEMBL11504466 0.72 TSHR (0.53) NPC1MAPTRAB9ASMN1; SMN2HTT
SCHEMBL11453166 0.72 TSHR (0.53) NPC1MAPTRAB9ASMN1; SMN2HTT
SCHEMBL2829189 0.71 SLC7A5 (0.35) SLC7A5LOXL2NPC1MAPTRAB9A
SCHEMBL11567424 0.68 MAPT (0.43) MAPTSMN1; SMN2HTTMEN1KMT2A
SCHEMBL27620272 0.68 LOXL2 (0.56) SLC7A5LOXL2NPC1MAPTRAB9A

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