SCHEMBL7566657

SCHEMBL7566657

O=NOCc1ccc(O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.50
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
ESR1 P03372 2/20 0.46
ESR2 Q92731 2/20 0.46
CA2 P00918 3/20 0.43
CAMK2A Q9UQM7 1/20 0.43
ABAT P80404 1/20 0.42
APP P05067 1/20 0.41
CTBP2 P56545 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HTR1A P08908 1/20 0.39
ADRA2A P08913 1/20 0.39
SLC6A2 P23975 1/20 0.39
CYP2C19 P33261 1/20 0.39
HTR3A P46098 1/20 0.39
BACE1 P56817 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
L3MBTL1 Q9Y468 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
SCHEMBL27856388 0.79 IDO1 (0.52) IDO1MEN1KMT2ACA2APP
SCHEMBL27901547 0.79 IDO1 (0.52) IDO1MEN1KMT2ACA2APP
SCHEMBL21447792 0.79 CYP3A4 (0.44) MEN1KMT2ACA2APPALDH1A1
SCHEMBL28286129 0.79 AGXT (0.52) IDO1KMT2ACA2ALDH1A1CYP2C19
SCHEMBL1425850 0.78 TSHR (0.52) IDO1MEN1KMT2ACA2ALDH1A1
Hydroxyamine SCHEMBL28178637 0.77 ALDH1A1 (0.50) IDO1MEN1KMT2ACA2ALDH1A1
Hydrochloric Acid SCHEMBL7794099 0.76 TSHR (0.50) IDO1MEN1KMT2ACA2ALDH1A1
Ammonia Solution, Strong SCHEMBL5804107 0.76 TSHR (0.50) IDO1MEN1KMT2ACA2ALDH1A1
SCHEMBL27646961 0.76 IDO1 (0.55) IDO1CA2APP
SCHEMBL28820711 0.74 APP (0.47) MEN1KMT2AAPPL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1089940-B1 METHOD FOR CONTROLLING THE GROWTH OF ALGAE BY USING SUBSTITUTED AMINO-ALCOHOLS TRIQUEST L P (US) 2002-03-27 EP disclosed
EP-1089940-A1 METHOD FOR CONTROLLING THE GROWTH OF ALGAE BY USING SUBSTITUTED AMINO-ALCOHOLS TRIQUEST, L.P. (US) 2001-04-11 EP disclosed
WO-2000018688-A1 METHOD FOR CONTROLLING THE GROWTH OF ALGAE BY USING SUBSTITUTED AMINO-ALCOHOLS TRIQUEST, LP (US) 2000-04-06 WO disclosed
US-5958836-A Algistats TRIQUEST, LP (US) 1999-09-28 US disclosed
EP-0752980-B1 SUBSTITUTED PHENYL COMPOUNDS AND PROCESSES FOR PREPARING THE SAME TRIQUEST L P (US) 1999-09-15 EP disclosed
EP-0752980-A1 SUBSTITUTED PHENYL COMPOUNDS AND PROCESSES FOR PREPARING THE SAME HOECHST CELANESE CORPORATION (US) 1997-01-15 EP disclosed
WO-1996002495-A1 DI-AMINO COMPOUNDS AND THEIR USE IN POLYURETHANE COMPOSITIONS, IN POLYAMIDE, POLYIMIDE, POLYUREA AND EPOXY RESIN HOECHST CELANESE CORPORATION (US) 1996-02-01 WO disclosed
WO-1995032179-A1 4-ALKOXYLATED BENZYLAMINE DERIVATIVES AND PROCESS FOR PREPARING THE SAME HOECHST CELANESE CORPORATION (US) 1995-11-30 WO disclosed
WO-1995026950-A1 SUBSTITUTED PHENYL COMPOUNDS AND PROCESSES FOR PREPARING THE SAME HOECHST CELANESE CORPORATION (US) 1995-10-12 WO disclosed
US-5424387-A Reacting alkali metal hydroxide with 4-hydroxyacetophenone forming salt, reacting salt with ethylene or propylene oxide forming oxyalkylated compound, reductive amination to form di-amino compound HOECHST CELANESE CORPORATION (US) 1995-06-13 US disclosed
US-5422417-A Phenolic hydroxy ethers useful as endcappers in polyethers or in polyetherurethane copolymers used for reaction injection molding of automobile parts HOECHST CELANESE CORPORATION (US) 1995-06-06 US disclosed
US-5399766-A Aminoethylbenzenes para-substituted with hydroxydialkoxy or hydroxypolyalkoxy; chain extenders and starting materials for polyurethanes and polyureas HOECHST CELANESE CORPORATION (US) 1995-03-21 US disclosed
US-5347051-A Chain extenders for polyureas and polyurethanes HOECHST CELANESE CORPORATION (US) 1994-09-13 US disclosed
US-5346983-A HAVING CHAIN EXTENSION ACTIVITY FOR USE IN MANUFACTURING POLYURETHANES HOECHST CELANESE CORPORATION (US) 1994-09-13 US disclosed
US-5347049-A Chain extenders for polyureas and polyurethanes HOECHST CELANESE CORPORATION (US) 1994-09-13 US disclosed
US-5312990-A Chain extenders for polyureas, polyurethanes HOECHST CELANESE CORPORATION (US) 1994-05-17 US disclosed
US-5300691-A Chain extenders for polyureas and polyurethanes HOECHST CELANESE CORPORATION (US) 1994-04-05 US disclosed