SCHEMBL7939012

SCHEMBL7939012

COc1c(O)ccc(C=O)c1C=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.59
CA2 P00918 1/20 0.59
ERN1 O75460 10/20 0.50
TRIM24 O15164 2/20 0.50
TRIM33 Q9UPN9 2/20 0.50
TYR P14679 1/20 0.50
ALDH1A1 P00352 3/20 0.42
LCK P06239 1/20 0.42
GLA P06280 1/20 0.42
MAPT P10636 1/20 0.42
THRB P10828 1/20 0.42
LIMK1 P53667 1/20 0.42
LIMK2 P53671 1/20 0.42
TLR2 O60603 1/20 0.42
TLR1 Q15399 1/20 0.42
TLR6 Q9Y2C9 1/20 0.42
HPGD P15428 1/20 0.42
ALDH5A1 P51649 1/20 0.42
ABAT P80404 1/20 0.42
TDP1 Q9NUW8 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
SCHEMBL8735765 0.86 CA1 (0.55) CA1CA2ERN1TRIM24TRIM33
SCHEMBL28577429 0.84 CA1 (0.47) CA1CA2ERN1TRIM24TRIM33
SCHEMBL1003414 0.84 CA1 (0.69) CA1CA2ERN1TRIM24TRIM33
SCHEMBL29459741 0.84 CA1 (0.69) CA1CA2ERN1TRIM24TRIM33
SCHEMBL5028869 0.83 CA1 (0.46) CA1CA2ERN1TRIM24TRIM33
SCHEMBL1005010 0.82 CA1 (0.61) CA1CA2ERN1TRIM24TRIM33
SCHEMBL29459651 0.82 CA1 (0.61) CA1CA2ERN1TRIM24TRIM33
SCHEMBL3936411 0.81 ERN1 (0.51) CA1CA2ERN1TRIM24TRIM33
SCHEMBL1361643 0.81 CA1 (0.59) CA1CA2ERN1TRIM24TRIM33
SCHEMBL1396832 0.80 CA1 (0.54) CA1CA2ERN1TRIM24TRIM33

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0044260-B1 PROCESS FOR THE PREPARATION OF POLYPHENOLS OPTIONALLY SUBSTITUTED BY AN ALDEHYDE GROUP RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1984-04-11 EP claimed
US-4435601-A OXIDATION WITH HYDROGEN PEROXIDE IN ALKALI OR ALKALINE METAL BASE RHONE-POULENC INDUSTRIES (FR) 1984-03-06 US claimed
EP-0044260-A2 Process for the preparation of polyphenols optionally substituted by an aldehyde group RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1982-01-20 EP claimed
US-10059731-B2 Process for depolymerization of lignin by laccases INSTITUT POLYTECHNIQUE DE BORDEAUX (FR) 2018-08-28 US disclosed
US-20160376300-A1 PROCESS FOR DEPOLYMERIZATION OF LIGNIN BY LACCASES INSTITUT OF POLYTECHNIQUE DE BORDEAUX (FR) 2016-12-29 US disclosed
CN-105899728-A Method for depolymerizing lignin by laccase 波尔多聚合技术研究所 2016-08-24 CN disclosed
US-6184421-B1 SELECTIVE OXIDATION, TO A CARBOXY GROUP, OF THE GROUP IN THE 2 POSITION WITH RESPECT TO THE HYDROXYL GROUPS OF A MIXTURE OF PHENOLS HAVING FORMYL AND/OR HYDROXYMETHYL GROUPS IN POSITIONS 2 OR 4; PREPARING VANILLIN AND ETHYL VANILLIN RHODIA CHIMIE (FR) 2001-02-06 US disclosed
EP-0044260-B1 PROCESS FOR THE PREPARATION OF POLYPHENOLS OPTIONALLY SUBSTITUTED BY AN ALDEHYDE GROUP RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1984-04-11 EP disclosed
US-4435601-A OXIDATION WITH HYDROGEN PEROXIDE IN ALKALI OR ALKALINE METAL BASE RHONE-POULENC INDUSTRIES (FR) 1984-03-06 US disclosed
US-4351962-A Process for the preparation of hydroxy benzene carboxaldehydes RHONE POULENC INC. (US) 1982-09-28 US disclosed
EP-0044260-A2 Process for the preparation of polyphenols optionally substituted by an aldehyde group RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1982-01-20 EP 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 (2 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-20160376300-A1 PROCESS FOR DEPOLYMERIZATION OF LIGNIN BY LACCASES LOX, LPO, LCT CA1 1988/4885CA2 1110/4885ERN1 2843/4885
US-10059731-B2 Process for depolymerization of lignin by laccases LOX, LPO, LCT CA1 1988/4885CA2 1110/4885ERN1 2843/4885

“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.