SCHEMBL3745804

SCHEMBL3745804

O=C(O)C(O)c1cc(Cl)ccc1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
MAPK1 P28482 3/20 0.45
MAPT P10636 3/20 0.45
NPSR1 Q6W5P4 3/20 0.45
HTT P42858 3/20 0.45
HPGD P15428 4/20 0.43
LMNA P02545 3/20 0.43
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
TSHR P16473 3/20 0.43
HSD17B10 Q99714 3/20 0.43
ALDH1A1 P00352 3/20 0.43
CYP3A4 P08684 3/20 0.43
TDP1 Q9NUW8 2/20 0.43
POLB P06746 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42

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
SCHEMBL3745809 1.00 CA1 (0.50) CA1CA2MEN1KMT2AMAPK1
SCHEMBL23972664 0.82 ALDH1A1 (0.48) MEN1KMT2AMAPK1LMNATSHR
SCHEMBL31435516 0.81 CES2 (0.46) CA1CA2MAPK1LMNATSHR
SCHEMBL23973184 0.81 CES2 (0.46) CA1CA2MAPK1LMNATSHR
SCHEMBL6591473 0.79 PTGS2 (0.57) CA1CA2MEN1KMT2AMAPK1
SCHEMBL8622029 0.79 MEN1 (0.54) CA1CA2MEN1KMT2AMAPK1
SCHEMBL5159165 0.78 TSHR (0.48) MEN1KMT2AMAPK1NPSR1HTT
SCHEMBL1513247 0.78 TSHR (0.48) MEN1KMT2AMAPK1NPSR1HTT
SCHEMBL10456166 0.78 BLM (0.59) MEN1KMT2AMAPK1MAPTNPSR1
Hydrochloric Acid SCHEMBL8617929 0.78 MEN1 (0.53) CA1CA2MEN1KMT2AMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2029515-B1 USE OF METAL COMPLEXES COMPRISING A LIGAND DERIVED FROM 2-ARYL-2-HYDROXYACETIC ACID AND A DIVALENT OR TRIVALENT METAL CATION FOR THE TREATMENT OF METAL DEFICIENCY IN PLANTS. WEYLCHEM LAMOTTE (FR) 2016-03-09 EP disclosed
EP-2029515-B1 USE OF METAL COMPLEXES COMPRISING A LIGAND DERIVED FROM 2-ARYL-2-HYDROXYACETIC ACID AND A DIVALENT OR TRIVALENT METAL CATION FOR THE TREATMENT OF METAL DEFICIENCY IN PLANTS. WEYLCHEM LAMOTTE (FR) 2016-03-09 EP disclosed
US-8372176-B2 Metal complexes comprising a ligand derived from 2-aryl-2-hydroxyacetic acid and a divalent or trivalent metal cation, and their use CLARIANT SPECIALTY FINE CHEMICALS (FRANCE) (FR) 2013-02-12 US disclosed
US-8372176-B2 Metal complexes comprising a ligand derived from 2-aryl-2-hydroxyacetic acid and a divalent or trivalent metal cation, and their use CLARIANT SPECIALTY FINE CHEMICALS (FRANCE) (FR) 2013-02-12 US disclosed
US-8372176-B2 Metal complexes comprising a ligand derived from 2-aryl-2-hydroxyacetic acid and a divalent or trivalent metal cation, and their use CLARIANT SPECIALTY FINE CHEMICALS (FRANCE) (FR) 2013-02-12 US disclosed
CN-102603368-A Metal complexes comprising ligands derived from 2-aryl-2-hydroxyacetic acid and divalent or trivalent metal cations and use thereof CLARIANT SPECIALTY FINE CHEM F 2012-07-25 CN disclosed
CN-101454268-B Metal complexes comprising ligands derived from 2-aryl-2-hydroxyacetic acid and divalent or trivalent metal cations and use thereof CLARIANT SPECIALTY FINE CHEM 2012-07-11 CN disclosed
US-20100288004-A1 Metal Complexes Comprising A Ligand Derived From 2-Aryl-2-Hydroxyacetic Acid And A Divalent Or Trivalent Metal Cation, And Their Use CLARIANT SPECIALTY FINE CHEMICALS (FRANCE) (FR) 2010-11-18 US disclosed
US-20100288004-A1 Metal Complexes Comprising A Ligand Derived From 2-Aryl-2-Hydroxyacetic Acid And A Divalent Or Trivalent Metal Cation, And Their Use CLARIANT SPECIALTY FINE CHEMICALS (FRANCE) (FR) 2010-11-18 US disclosed
US-20100288004-A1 Metal Complexes Comprising A Ligand Derived From 2-Aryl-2-Hydroxyacetic Acid And A Divalent Or Trivalent Metal Cation, And Their Use CLARIANT SPECIALTY FINE CHEMICALS (FRANCE) (FR) 2010-11-18 US disclosed
CN-101454268-A Metal complexes comprising ligands derived from 2-aryl-2-hydroxyacetic acid and divalent or trivalent metal cations and use thereof CLARIANT SPECIALTY FINE CHEM (FR) 2009-06-10 CN disclosed
EP-2029515-A1 METAL COMPLEXES COMPRISING A LIGAND DERIVED FROM 2-ARYL-2-HYDROXYACETIC ACID AND A DIVALENT OR TRIVALENT METAL CATION, AND THEIR USE Clariant Specialty Fine Chemicals (France) (FR) 2009-03-04 EP disclosed
WO-2007135109-A1 METAL COMPLEXES COMPRISING A LIGAND DERIVED FROM 2-ARYL-2-HYDROXYACETIC ACID AND A DIVALENT OR TRIVALENT METAL CATION, AND THEIR USE CLARIANT SPECIALTY FINE CHEMICALS (FRANCE) (FR) 2007-11-29 WO disclosed
WO-2007135109-A1 METAL COMPLEXES COMPRISING A LIGAND DERIVED FROM 2-ARYL-2-HYDROXYACETIC ACID AND A DIVALENT OR TRIVALENT METAL CATION, AND THEIR USE CLARIANT SPECIALTY FINE CHEMICALS (FRANCE) (FR) 2007-11-29 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 (1 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-20100288004-A1 Metal Complexes Comprising A Ligand Derived From 2-Aryl-2-Hydroxyacetic Acid And A Divalent Or Trivalent Metal Cation, And Their Use HACL2, HAO2, HCAR2 CA1 1077/4885CA2 54/4885MEN1 4033/4885

“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.