SCHEMBL2943970

SCHEMBL2943970

O=Cc1cc2ccccc2c(-c2c(O)c(C=O)cc3ccccc23)c1O

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 13/20 0.63
PADI4 Q9UM07 1/20 0.42
NQO1 P15559 1/20 0.42
TRIM24 O15164 1/20 0.42
TRIM33 Q9UPN9 1/20 0.42
PIM1 P11309 1/20 0.42
ALOX5 P09917 1/20 0.42
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
TRPM4 Q8TD43 1/20 0.41

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
SCHEMBL31152504 1.00 ERN1 (0.63) ERN1PADI4NQO1TRIM24TRIM33
SCHEMBL30071644 1.00 ERN1 (0.63) ERN1PADI4NQO1TRIM24TRIM33
SCHEMBL3416460 0.90 MEN1 (0.55) ERN1PIM1ALOX5MEN1MAPT
SCHEMBL30539187 0.90 MEN1 (0.55) ERN1PIM1ALOX5MEN1MAPT
SCHEMBL12961715 0.89 ERN1 (0.52) ERN1NQO1MEN1MAPTKMT2A
SCHEMBL30940210 0.89 ERN1 (0.52) ERN1PADI4NQO1PIM1ALOX5
SCHEMBL30940211 0.89 ERN1 (0.52) ERN1PADI4NQO1PIM1ALOX5
SCHEMBL354162 0.87 ERN1 (0.54) ERN1NQO1
SCHEMBL29618439 0.87 ERN1 (0.54) ERN1NQO1
SCHEMBL10331756 0.86 ERN1 (0.65) ERN1PADI4NQO1TRIM24TRIM33

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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117567286-A Fluorescent probe for specifically recognizing chiral threitol, preparation and application thereof 海南大学 2024-02-20 CN claimed
CN-115340458-B Compound for recognizing chiral arginine, fluorescent probe and preparation method thereof 海南大学 2023-05-26 CN claimed
CN-109912560-A One kind has aggregation-induced emission effect and the fluorescent material of circular polarization and preparation method thereof 陕西师范大学 2019-06-21 CN claimed
CN-117567286-A Fluorescent probe for specifically recognizing chiral threitol, preparation and application thereof 海南大学 2024-02-20 CN disclosed
CN-115677648-B Synthesis method of high optical purity lactide 扬州大学 2023-12-08 CN disclosed
CN-115340458-B Compound for recognizing chiral arginine, fluorescent probe and preparation method thereof 海南大学 2023-05-26 CN disclosed
CN-115677648-A Synthesis method of lactide with high optical purity 扬州大学 2023-02-03 CN disclosed
CN-115340458-A Compound for identifying chiral arginine, fluorescent probe and preparation method thereof 海南大学 2022-11-15 CN disclosed
CN-109912560-B Fluorescent material with aggregation-induced emission effect and circular polarization and preparation method thereof 陕西师范大学 2021-03-23 CN disclosed
US-10711101-B2 Isotactic polyethers and bimetallic catalysts, methods of making same, and uses thereof CORNELL UNIVERSITY (US) 2020-07-14 US disclosed
CN-109912560-A One kind has aggregation-induced emission effect and the fluorescent material of circular polarization and preparation method thereof 陕西师范大学 2019-06-21 CN disclosed
US-20100144969-A1 ISOSELECTIVE POLYMERIZATION OF EPOXIDES CORNELL UNIVERSITY (US) 2010-06-10 US disclosed
US-20100144969-A1 ISOSELECTIVE POLYMERIZATION OF EPOXIDES CORNELL UNIVERSITY (US) 2010-06-10 US disclosed
US-20100144969-A1 ISOSELECTIVE POLYMERIZATION OF EPOXIDES CORNELL UNIVERSITY (US) 2010-06-10 US disclosed
WO-2009026261-A2 ISOSELECTIVE POLYMERIZATION OF EPOXIDES CORNELL RESEARCH FOUNDATION, INC. (US) 2009-02-26 WO disclosed
WO-2009026261-A2 ISOSELECTIVE POLYMERIZATION OF EPOXIDES CORNELL RESEARCH FOUNDATION, INC. (US) 2009-02-26 WO disclosed
US-20080213916-A1 Allosterically Catalyzed Signal Amplification in Chemical and Biological Sensing NORTHWESTERN UNIVERSITY (US) 2008-09-04 US disclosed
WO-2007053181-A2 CHEMICALLY TAILORABLE NANOPARTICLES REALIZED THROUGH METAL-METALLOLIGAND COORDINATION CHEMISTRY NORTHWESTERN UNIVERSITY (US) 2007-05-10 WO disclosed
WO-2007018549-A9 ALLOSTERICALLY CATALYZED SIGNAL AMPLIFICATION IN CHEMICAL AND BIOLOGICAL SENSING UNIV NORTHWESTERN (US) 2007-05-03 WO disclosed
WO-2007018549-A2 ALLOSTERICALLY CATALYZED SIGNAL AMPLIFICATION IN CHEMICAL AND BIOLOGICAL SENSING NORTHWESTERN UNIVERSITY (US) 2007-02-15 WO 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-20080213916-A1 Allosterically Catalyzed Signal Amplification in Chemical and Biological Sensing CASR, MAVS, STAT3 ERN1 1741/4885PADI4 4170/4885NQO1 565/4885
US-20100144969-A1 ISOSELECTIVE POLYMERIZATION OF EPOXIDES EPHX2, EPHX1, GNE ERN1 1408/4885PADI4 2729/4885NQO1 194/4885
US-10711101-B2 Isotactic polyethers and bimetallic catalysts, methods of making same, and uses thereof SQLE, PAOX, AGL ERN1 2819/4885PADI4 4883/4885NQO1 2653/4885

“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.