SCHEMBL2850824

SCHEMBL2850824

C=CCOc1cc(C=O)c(O)c(C=O)c1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 9/20 0.45
MAPT P10636 2/20 0.41
ALDH1A1 P00352 2/20 0.41
GAA P10253 2/20 0.41
HPGD P15428 2/20 0.41
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CA12 O43570 3/20 0.40
CA1 P00915 3/20 0.40
CA9 Q16790 3/20 0.40
CA2 P00918 1/20 0.40
CA7 P43166 1/20 0.40
SLC5A1 P13866 1/20 0.39
SLC5A2 P31639 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
SCHEMBL22278278 0.82 ERN1 (0.57) ERN1MAPTALDH1A1GAAHPGD
SCHEMBL2853452 0.80 ALDH1A1 (0.42) ERN1MAPTALDH1A1LMNA
SCHEMBL6561561 0.79 TRIM24 (0.57) MAPTALDH1A1GAAHPGDMEN1
SCHEMBL22266039 0.77 TUBB1 (0.46) MAPTALDH1A1GAAHPGDMEN1
SCHEMBL3818350 0.76 MAPT (0.47) MAPTALDH1A1GAAHPGDMEN1
SCHEMBL663655 0.76 CA12 (0.42) MAPTALDH1A1GAAHPGDMEN1
SCHEMBL13836564 0.76 CA12 (0.42) MAPTALDH1A1GAAHPGDMEN1
SCHEMBL16015475 0.75 SLC5A1 (0.46) MAPTALDH1A1GAAHPGDMEN1
SCHEMBL18984966 0.75 SLC5A1 (0.46) MAPTALDH1A1GAAHPGDMEN1
SCHEMBL22779337 0.75 CA12 (0.44) MAPTALDH1A1GAAHPGDMEN1

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
CN-1988954-B Catalysts based on metal complexes for the synthesis of optically active chrysanthemic acid ENDURA SPA 2012-01-18 CN disclosed
US-20100204038-A1 Catalysts based on metal complexes for the synthesis of optically active chrysanthemic acid CARLONI SILVIA 2010-08-12 US disclosed
EP-1765496-B1 CATALYSTS BASED ON COPPER COMPLEXES FOR THE SYNTHESIS OF OPTICALLY ACTIVE CHRYSANTHEMIC ACID ENDURA SPA (IT) 2010-07-14 EP disclosed
US-7723539-B2 Catalysts based on metal complexes for the synthesis of optically active chrysanthemic acid ENDURA S.P.A. (IT) 2010-05-25 US disclosed
US-20080021237-A1 Catalysts Based on Metal Complexes for the Synthesis of Optically Active Chrysanthemic Acid ENDURA S.P.A. (IT) 2008-01-24 US disclosed
CN-1988954-A Catalysts based on metal complexes for the synthesis of optically active chrysanthemic acid ENDURA SPA (IT) 2007-06-27 CN disclosed
EP-1765496-A1 CATALYSTS BASED ON METAL COMPLEXES FOR THE SYNTHESIS OF OPTICALLY ACTIVE CHRYSANTHEMIC ACID ENDURA S.p.A. (IT) 2007-03-28 EP disclosed
WO-2005123254-A1 CATALYSTS BASED ON METAL COMPLEXES FOR THE SYNTHESIS OF OPTICALLY ACTIVE CHRYSANTHEMIC ACID ENDURA S.P.A. (IT) 2005-12-29 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-20080021237-A1 Catalysts Based on Metal Complexes for the Synthesis of Optically Active Chrysanthemic Acid SCO2, ME1, ME3 ERN1 4286/4885MAPT 1247/4885ALDH1A1 1925/4885

“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.