SCHEMBL459656

SCHEMBL459656

O=C(c1ccccc1)C(O)(Oc1ccccc1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 5/20 0.49
SRC P12931 1/20 0.44
AKR1C3 P42330 1/20 0.38
MAPT P10636 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
F2 P00734 1/20 0.38
LMNA P02545 1/20 0.38
CES2 O00748 3/20 0.37
TSHR P16473 2/20 0.37
DAO P14920 1/20 0.37
NAPRT Q6XQN6 1/20 0.37
ALDH1A1 P00352 1/20 0.37
KCNN4 O15554 1/20 0.36
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
CYP1A2 P05177 1/20 0.35
MAPK1 P28482 1/20 0.35
HIF1A Q16665 1/20 0.35
PARP10 Q53GL7 1/20 0.35

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
SCHEMBL9284323 0.90 CES1 (0.44) CES1SRCMAPTTDP1L3MBTL1
SCHEMBL10878211 0.82 CYP1A2 (0.43) CES1MAPTTSHRALDH1A1KCNN4
SCHEMBL11101775 0.82 CES1 (0.53) CES1SRCMAPTTDP1L3MBTL1
SCHEMBL621110 0.81 CES1 (0.52) CES1SRCMAPTTDP1L3MBTL1
SCHEMBL7593319 0.79 CES1 (0.65) CES1SRCAKR1C3MAPTTDP1
SCHEMBL277653 0.79 CES1 (0.65) CES1SRCMAPTTDP1L3MBTL1
SCHEMBL16280591 0.79 CES1 (0.50) CES1SRCMAPTTDP1L3MBTL1
SCHEMBL2818433 0.79 CES1 (0.50) CES1SRCMAPTTDP1L3MBTL1
Methoxymethane SCHEMBL36163 0.78 CES1 (0.62) CES1SRCMAPTTDP1L3MBTL1
SCHEMBL6528610 0.76 CES1 (0.47) CES1SRCMAPTTDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0340216-B1 COMPOSITIONS INCLUDING HERBICIDAL COMBINATIONS OF THE GLYPHOSATE TYPE AND THE PHENOXYBENZOIC TYPE RHONE-POULENC AGROCHIMIE (FR) 1993-05-19 EP claimed
EP-0089538-B1 OPTICALLY ACTIVE DERIVATIVES OF PHENOXY-BENZOIC ACID, PROCESS FOR THEIR PREPARATION AND THEIR USE AS HERBICIDES BAYER AG (DE) 1985-01-30 EP claimed
WO-2024079245-A1 RIDINILAZOLE FOR TREATING CLOSTRIDIUM DIFFICILE SUMMIT (OXFORD) LIMITED (GB) 2024-04-18 WO disclosed
WO-2023213878-A1 SOLID TABLET DOSAGE FORM OF RIDINILAZOLE SUMMIT (OXFORD) LIMITED (GB) 2023-11-09 WO disclosed
EP-3766527-B1 OSTEOINDUCTIVE BONE IMPLANT AND METHOD FOR ITS IRRADIATION WITH ELECTRON BEAMS WARSAW ORTHOPEDIC INC (US) 2023-09-13 EP disclosed
WO-2023105491-A1 5,6,7,8-TETRAHYDRO-2,6-NAPHTHYRIDINE DERIVATIVES AS CANCER THERAPEUTICS VRISE THERAPEUTICS, INC. (US) 2023-06-15 WO disclosed
WO-2022153056-A1 PROCESS FOR PURIFYING RIDINILAZOLE SUMMIT (OXFORD) LIMITED (GB) 2022-07-21 WO disclosed
EP-3999502-A1 PROCESS FOR THE PREPARATION OF RIDINILAZOLE AND CRYSTALLINE FORMS THEREOF Summit (Oxford) Limited (GB) 2022-05-25 EP disclosed
EP-3367973-B1 IMPLANTS HAVING A DRUG LOAD OF AN OXYSTEROL AND METHODS OF USE WARSAW ORTHOPEDIC INC (US) 2022-03-23 EP disclosed
US-9987290-B2 Methods for the separation and detection of an oxysterol WARSAW ORTHOPEDIC, INC. (US) 2018-06-05 US disclosed
US-20170273990-A1 METHODS FOR THE SEPARATION AND DETECTION OF AN OXYSTEROL WARSAW ORTHOPEDIC, INC. 2017-09-28 US disclosed
EP-0341607-A2 Anticoagulant peptide alcohols MERRELL DOW PHARMACEUTICALS INC. (US) 1989-11-15 EP disclosed
EP-0340216-A1 COMPOSITIONS INCLUDING HERBICIDAL COMBINATIONS OF THE GLYPHOSATE TYPE AND THE PHENOXYBENZOIC TYPE RHONE-POULENC AGROCHIMIE (FR) 1989-11-08 EP disclosed
EP-0320983-A2 Piperidinyl compounds MERRELL DOW PHARMACEUTICALS INC. (US) 1989-06-21 EP disclosed
WO-1989003641-A1 COMPOSITIONS INCLUDING HERBICIDAL COMBINATIONS OF THE GLYPHOSATE TYPE AND THE PHENOXYBENZOIC TYPE RHONE POULENC AGROCHIMIE (FR) 1989-05-05 WO disclosed
EP-0297534-A2 Castanospermine esters and glycosides MERRELL DOW PHARMACEUTICALS INC. (US) 1989-01-04 EP disclosed
CN-87107479-A Herbicidal composition based on a herbicide of the glyphosate type and on a herbicide of the phenoxybenzoic type and method for controlling weeds using these compositions 1988-08-10 CN disclosed
CN-87107479-A Herbicidal composition based on a herbicide of the glyphosate type and on a herbicide of the phenoxybenzoic type and method for controlling weeds using these compositions 1988-08-10 CN disclosed
EP-0255794-A1 Process for preparing an aromatic acid RHONE-POULENC CHIMIE (FR) 1988-02-10 EP disclosed
US-4242121-A USING A PHENOXYBENZOIC ACID, ITS ESTER OR SALT IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1980-12-30 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-20170273990-A1 METHODS FOR THE SEPARATION AND DETECTION OF AN OXYSTEROL OSBP2, NR1H3, OSBP CES1 394/4885SRC 4274/4885AKR1C3 317/4885

“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.