SCHEMBL11275375

SCHEMBL11275375

O=Cc1ccc(CCl)cc1O

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TYR P14679 2/20 0.47
TRIM24 O15164 2/20 0.47
TRIM33 Q9UPN9 2/20 0.47
CDK1 P06493 1/20 0.46
ERN1 O75460 5/20 0.42
PIK3CD O00329 1/20 0.40
PIK3CA P42336 1/20 0.40
PIK3CB P42338 1/20 0.40
PIK3CG P48736 1/20 0.40
PRKDC P78527 1/20 0.40
TTR P02766 1/20 0.40
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL29942484 0.84 CDK1 (0.65) TRIM24TRIM33CDK1ERN1
SCHEMBL918099 0.84 CDK1 (0.65) TRIM24TRIM33CDK1ERN1
SCHEMBL21002110 0.83 CDK1 (0.58) TYRTRIM24TRIM33CDK1PIK3CD
SCHEMBL21001943 0.83 CA1 (0.54) TYRTRIM24TRIM33CDK1PIK3CD
SCHEMBL2735986 0.82 TYR (0.48) TYRTRIM24TRIM33CDK1ERN1
SCHEMBL12450028 0.80 TYR (0.47) TYRTRIM24TRIM33CDK1ERN1
SCHEMBL14760953 0.80 XDH (0.42) TTRPOLBMAPTTDP1
SCHEMBL29951419 0.80 TYR (0.47) TYRTRIM24TRIM33CDK1ERN1
SCHEMBL1527080 0.80 TRPA1 (0.57) TYRTRIM24TRIM33CDK1PIK3CD
SCHEMBL12432290 0.78 CDK1 (0.58) CDK1MAPTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9346768-B2 Molecular glasses with functionalizable groups HER MAJESTY THE QUEEN IN RIGHT OF CANADA AS REPRESENTED BY THE MINISTER OF NATIONAL DEFENSE (CA) 2016-05-24 US disclosed
US-9328076-B2 Molecular glasses with functionalizable groups HER MAJESTY IN THE RIGHT OF CANADA AS REPRESENTED BY THE MINISTER OF DEFENSE (CA) 2016-05-03 US disclosed
US-20150232433-A1 Molecular Glasses With Functionalizable Groups HER MAJESTY THE QUEEN IN RIGHT OF CANADA AS REPRESENTED BY THE MINISTER OF NATIONAL DEFENCE (CA) 2015-08-20 US disclosed
EP-2562170-B1 Process for production of 3-[5-[4-(cyclopentyloxy)-2-hydroxybenzoyl]-2-[(3-oxo-2-substituted-2,3-dihydro-1,2-benzisoxazol-6-yl)methoxy]phenyl]propionate ester and intermediate for the process TOYAMA CHEMICAL CO LTD (JP) 2014-10-29 EP disclosed
US-20140005370-A1 MOLECULAR GLASSES WITH FUNCTIONALIZABLE GROUPS HER MAJESTY THE QUEEN IN RIGHT OF CANADA AS REPRESENTED BY THE MINISTER OF NATIONAL DEFENCE (CA) 2014-01-02 US disclosed
CN-101712697-B Ferrocene phosphinimine ligand containing imidazole salt group, preparation thereof and application in catalyzing asymmetric allyl substitution reaction BEIJING INST TECHNOLOGY 2011-09-07 CN disclosed
CN-101712697-A Ferrocene phosphinimine ligand containing imidazole salt group, preparation thereof and application in catalyzing asymmetric allyl substitution reaction BEIJING INST TECHNOLOGY 2010-05-26 CN disclosed
CN-1196692-C Substituted benzopyran derivatives for the treatment of inflammation SEARLE & CO (US) 2005-04-13 CN disclosed
CN-1520324-A Antiangiogenic combination thereapy for treatment of cancer 2004-08-11 CN disclosed
CN-1515566-A Substituted chromene derivative for curing inflammation G.D. 2004-07-28 CN disclosed
CN-1150181-C Substituted benzopyran analogs for treatment of inflammation GD 2004-05-19 CN disclosed
CN-1329607-A Substituted benzopyran analogs for the treatment of inflammation SEARLE & CO (US) 2002-01-02 CN disclosed
CN-1257489-A Substituted benzopyran derivatives for the treatment of inflammation SEARLE & CO (US) 2000-06-21 CN disclosed
US-4317887-A NUCLEOPHILIC-MODIFIED POLYACRYLAMIDE, POLYSTYRENE, AND DIVINYLBENZENE-STYRENE COPOLYMER; ION EXCHANGE RESINS; FIREPROOFING YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 1982-03-02 US disclosed
US-4220726-A POLYSTYRENE OR COPOLYMER; COMPLEXING YEDA RESEARCH & DEVELOPMENT CO. LTD. (IL) 1980-09-02 US disclosed
US-4154674-A SELECTIVE REMOVAL OF ANIONS OR CATIONS USING ION EXCHANGE RESINS YEDA RESEARCH & DEVELOPMENT CO., LTD. (IL) 1979-05-15 US disclosed
US-3974110-A Modification of polystyrene by Friedel-Crafts reaction with substituted halo ethyl benzenes and haloethylphenols to make supports for solid phase peptide synthesis YEDA RESEARCH & DEVELOPMENT CO. LTD. (IL) 1976-08-10 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 (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-20140005370-A1 MOLECULAR GLASSES WITH FUNCTIONALIZABLE GROUPS GNG2, GDI1, F12 TYR 585/4885TRIM24 3912/4885TRIM33 4556/4885
US-20150232433-A1 Molecular Glasses With Functionalizable Groups GDI1, GNG2, F12 TYR 589/4885TRIM24 3915/4885TRIM33 4526/4885

“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.