SCHEMBL9988192

SCHEMBL9988192

O=C(O)C(O)c1ccc2ccccc2c1O

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.53
RCE1 Q9Y256 4/20 0.50
PTPN22 Q9Y2R2 1/20 0.47
HSP90AA1 P07900 1/20 0.44
LMNA P02545 2/20 0.44
MAPK1 P28482 1/20 0.44
CYP1B1 Q16678 2/20 0.43
ABCG2 Q9UNQ0 1/20 0.43
CYP1A1 P04798 1/20 0.43

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
SCHEMBL1826565 0.79 ALDH1A1 (0.50) LMNAMAPK1
SCHEMBL4955989 0.79 ALDH1A1 (0.50) LMNAMAPK1
SCHEMBL4954667 0.79 ALDH1A1 (0.50) LMNAMAPK1
SCHEMBL14376212 0.79 ALDH1A1 (0.50) LMNAMAPK1
SCHEMBL28513422 0.76 RCE1 (0.59) LDHARCE1PTPN22HSP90AA1LMNA
SCHEMBL17540622 0.76 PTPN22 (0.52) LDHARCE1PTPN22HSP90AA1
SCHEMBL7210924 0.75 KDM4E (0.54) LDHAPTPN22LMNAMAPK1
SCHEMBL11571555 0.74 LMNA (0.50) LMNAMAPK1
SCHEMBL9749915 0.74 RCE1 (0.61) LDHARCE1PTPN22HSP90AA1
SCHEMBL11526099 0.74 IDO1 (0.50) LDHALMNAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8431750-B2 Preparation of hydroxyaromatic aldehydes RHODIA OPERATIONS (FR) 2013-04-30 US claimed
US-20110306802-A1 PREPARATION OF HYDROXYAROMATIC ALDEHYDES SPECIALTY OPERATIONS FRANCE (FR) 2011-12-15 US claimed
CN-101678333-A Process for preparing a hydroxyaromatic aldehyde RHODIA OPERATIONS 2010-03-24 CN claimed
US-4339602-A Process of preparation of racemic hydroxyarylglycolic acids and novel products resulting therefrom SOCIETE FRANCAISE HOECHST (FR) 1982-07-13 US claimed
US-8431750-B2 Preparation of hydroxyaromatic aldehydes RHODIA OPERATIONS (FR) 2013-04-30 US disclosed
US-20110306802-A1 PREPARATION OF HYDROXYAROMATIC ALDEHYDES SPECIALTY OPERATIONS FRANCE (FR) 2011-12-15 US disclosed
CN-101678333-A Process for preparing a hydroxyaromatic aldehyde RHODIA OPERATIONS 2010-03-24 CN disclosed
US-4339602-A Process of preparation of racemic hydroxyarylglycolic acids and novel products resulting therefrom SOCIETE FRANCAISE HOECHST (FR) 1982-07-13 US disclosed
US-4339602-A Process of preparation of racemic hydroxyarylglycolic acids and novel products resulting therefrom SOCIETE FRANCAISE HOECHST (FR) 1982-07-13 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 (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-20110306802-A1 PREPARATION OF HYDROXYAROMATIC ALDEHYDES AOX1, ALDH2, ALDH1A1 LDHA 57/4885RCE1 824/4885PTPN22 4239/4885

“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.