SCHEMBL3653095

SCHEMBL3653095

COc1ccc(CC(=O)Nc2ccccc2)cc1OC

nearest known ligand 0.77

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.77
BCHE P06276 3/20 0.77
ACHE P22303 3/20 0.77
SMN1; SMN2 Q16637 4/20 0.74
LMNA P02545 4/20 0.74
KMT2A Q03164 3/20 0.74
HTT P42858 3/20 0.74
KDM4E B2RXH2 2/20 0.73
STAT3 P40763 1/20 0.70
NPSR1 Q6W5P4 3/20 0.70
MAPT P10636 3/20 0.70
ALDH1A1 P00352 2/20 0.70
HSD17B10 Q99714 2/20 0.70
POLB P06746 2/20 0.70
HPGD P15428 1/20 0.70
RXFP1 Q9HBX9 1/20 0.70
MEN1 O00255 1/20 0.67
TSHR P16473 1/20 0.67
MAPK1 P28482 1/20 0.67

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
SCHEMBL11275576 0.87 KMT2A (0.67) EPHX2BCHEACHESMN1; SMN2LMNA
SCHEMBL28020357 0.87 BCHE (0.68) EPHX2BCHEACHESMN1; SMN2LMNA
SCHEMBL19427446 0.87 EPHX2 (0.80) EPHX2BCHEACHESMN1; SMN2LMNA
SCHEMBL5313746 0.86 GAA (0.81) EPHX2BCHEACHESMN1; SMN2LMNA
SCHEMBL7872336 0.85 KMT2A (0.80) EPHX2BCHEACHESMN1; SMN2LMNA
SCHEMBL1645810 0.84 KMT2A (0.71) EPHX2BCHEACHESMN1; SMN2LMNA
SCHEMBL2840181 0.83 BCHE (0.63) EPHX2BCHEACHESMN1; SMN2LMNA
SCHEMBL28618230 0.82 CHEK1 (0.63) EPHX2BCHEACHESMN1; SMN2LMNA
SCHEMBL4047959 0.82 EPHX2 (0.67) EPHX2BCHEACHESMN1; SMN2LMNA
SCHEMBL7243154 0.82 LMNA (0.69) EPHX2BCHEACHESMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8394835-B2 Aromatic compounds and their use in medical applications REVOTAR BIOPHARMACEUTICALS AG (DE) 2013-03-12 US disclosed
US-8367677-B2 Comprising trihydroxy phenyl subunits; selectin inhibitors; side effect reduction; 3-{3-[3-(3,4,5-Trihydroxy-phenyl)-propionylamino]-phenylamino}-benzoic acid REVOTAR BIOPHARMACEUTICALS AG (DE) 2013-02-05 US disclosed
US-20110152291-A1 NOVEL AROMATIC COMPOUNDS AND THEIR USE IN MEDICAL APPLICATIONS REVOTAR BIOPHARMACEUTICALS AG (DE) 2011-06-23 US disclosed
US-7923473-B2 Moderate binding of selectins ; chronic obstructive pulmonary disease; Crohn's disease; sepsis; antiinflammatory agents; skin disorders; antiarthritic agents; cardiovascular disorders; autoimmune diseases ' REVOTAR BIOPHARMACEUTICALS AG (DE) 2011-04-12 US disclosed
EP-2195029-A2 TREATMENT AND PREVENTION OF NEURODEGENERATIVE DISEASES Oryzon Genomics SA (ES) 2010-06-16 EP disclosed
WO-2009027349-A2 TREATMENT AND PREVENTION OF NEURODEGENERATIVE DISEASES ORYZON GENOMICS SA (ES) 2009-03-05 WO disclosed
US-20080249107-A1 Non-Glycosylated/Non-Glycosidic/Non-Peptidic Small Molecule Psgl-1 Mimetics for the Treatment of Inflammatory Disorders REVOTAR BIOPHARMACEUTICALS AG (DE) 2008-10-09 US disclosed
US-20080207639-A1 Novel Aromatic Compounds and Their Use in Medical Applications REVOTAR BIOPHARMACEUTICALS AG (DE) 2008-08-28 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110152291-A1 NOVEL AROMATIC COMPOUNDS AND THEIR USE IN MEDICAL APPLICATIONS SELP, SELL, SELE EPHX2 1280/4885BCHE 4075/4885ACHE 3558/4885
US-20080207639-A1 Novel Aromatic Compounds and Their Use in Medical Applications SELP, SELL, SELE EPHX2 1133/4885BCHE 4100/4885ACHE 3513/4885
US-20080249107-A1 Non-Glycosylated/Non-Glycosidic/Non-Peptidic Small Molecule Psgl-1 Mimetics for the Treatment of Inflammatory Disorders SELP, SELPLG, SELE EPHX2 2645/4885BCHE 2604/4885ACHE 4695/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.