SCHEMBL8633748

SCHEMBL8633748

CCC(=O)N(C)CCCO

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.39
EPHX2 P34913 2/20 0.35
ALDH1A1 P00352 3/20 0.34
BCHE P06276 2/20 0.33
ACHE P22303 2/20 0.33
SIGMAR1 Q99720 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
MAPT P10636 1/20 0.32
KDM4E B2RXH2 1/20 0.31
LMNA P02545 3/20 0.31
HSD17B10 Q99714 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TSHR P16473 1/20 0.31
CYP4F2 P78329 2/20 0.31
CYP4A11 Q02928 2/20 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
SCHEMBL29069580 0.91 EPHX2 (0.40) CNR1EPHX2ALDH1A1BCHEACHE
Ethaneperoxoic Acid SCHEMBL31099400 0.88 CNR1 (0.33) CNR1EPHX2ALDH1A1BCHEACHE
SCHEMBL7320291 0.85
SCHEMBL4146764 0.83 ALDH1A1 (0.46) CNR1EPHX2ALDH1A1SIGMAR1SMN1; SMN2
Phenol SCHEMBL28206816 0.82 BCHE (0.43) ALDH1A1BCHEACHESMN1; SMN2MAPT
SCHEMBL8633444 0.82 CNR1 (0.47) CNR1EPHX2ALDH1A1BCHEACHE
SCHEMBL7930805 0.82 ALDH1A1 (0.37) CNR1EPHX2ALDH1A1SIGMAR1LMNA
SCHEMBL17624920 0.81 EPHX2 (0.50) CNR1EPHX2ALDH1A1SIGMAR1
SCHEMBL15670632 0.81 EPHX2 (0.35) CNR1EPHX2ALDH1A1BCHEACHE
SCHEMBL10288645 0.81 ALDH1A1 (0.39) EPHX2ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0853107-A1 Ink jet ink compositions comprising hydroxyamide derivatives and printing processes XEROX CORPORATION (US) 1998-07-15 EP claimed
US-5693129-A AQUEOUS MIXCTURE CONTAINING COLORING AND A HYDROXYAMIDE, THIOAMIDE, MERCAPTOAMIDE, MERCAPTOTHIOAMIDE OR AN OXYALKYLENE OR A THIOALKYLENE REACTION PRODUCT OF THE AMIDES, FOR HIGH RESOLUTION, REDUCED CURLING XEROX CORPORATION (US) 1997-12-02 US claimed
CN-118679164-A Photodynamic therapy and diagnosis RMW曹氏集团有限公司 2024-09-20 CN disclosed
WO-2023094680-A1 PHOTODYNAMIC THERAPY AND DIAGNOSIS RMW CHO GROUP LIMITED (CN) 2023-06-01 WO disclosed
WO-2023094677-A1 PHOTODYNAMIC THERAPY AND DIAGNOSIS RMW CHO GROUP LIMITED (CN) 2023-06-01 WO disclosed
CN-108137556-A 1, 4-dicarbonyl-piperidinyl derivatives 默克专利股份公司 2018-06-08 CN disclosed
CN-104066734-B Triazol [4,5 d] pyrimidine derivatives 默克专利股份公司 2017-03-29 CN disclosed
CN-105873591-A A 6-oxo-1,6-dihydro-pyridazine derivative for the use for the treatment of renal cell carcinoma (RCC) 默克专利股份公司 2016-08-17 CN disclosed
WO-2014068171-A1 N-SUBSTITUTED 4-AMINOPHENOLS AND CORRESPONDING QUINONE IMINES MEDEIA THERAPEUTICS LTD (FI) 2014-05-08 WO disclosed
EP-0853107-A1 Ink jet ink compositions comprising hydroxyamide derivatives and printing processes XEROX CORPORATION (US) 1998-07-15 EP disclosed
US-5693129-A AQUEOUS MIXCTURE CONTAINING COLORING AND A HYDROXYAMIDE, THIOAMIDE, MERCAPTOAMIDE, MERCAPTOTHIOAMIDE OR AN OXYALKYLENE OR A THIOALKYLENE REACTION PRODUCT OF THE AMIDES, FOR HIGH RESOLUTION, REDUCED CURLING XEROX CORPORATION (US) 1997-12-02 US disclosed