SCHEMBL4139426

SCHEMBL4139426

Cc1cc(CCC([O])=O)cc(C(C)(C)C)c1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 6/20 0.55
KMT2A Q03164 5/20 0.51
MEN1 O00255 4/20 0.49
CYP1A2 P05177 3/20 0.49
CYP2C9 P11712 2/20 0.49
CYP2C19 P33261 2/20 0.49
ALDH1A1 P00352 5/20 0.41
TSHR P16473 3/20 0.41
CYP3A4 P08684 2/20 0.41
MAPK1 P28482 2/20 0.41
BLM P54132 2/20 0.41
ATM Q13315 2/20 0.41
HIF1A Q16665 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
USP2 O75604 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPT P10636 1/20 0.41
LMNA P02545 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
AGTR1 P30556 1/20 0.41

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
SCHEMBL9155201 0.90 GAA (0.66) GAAKMT2AMEN1CYP1A2CYP2C9
SCHEMBL29387462 0.87 GAA (0.55) GAAKMT2AMEN1CYP1A2CYP2C9
Hydrogen Peroxide SCHEMBL28104512 0.87 GAA (0.55) GAAKMT2AMEN1CYP1A2CYP2C9
SCHEMBL39866 0.87 GAA (0.55) GAAKMT2AMEN1CYP1A2CYP2C9
SCHEMBL11704984 0.87 GAA (0.55) GAAKMT2AMEN1CYP1A2CYP2C9
Ammonia Solution, Strong SCHEMBL5491694 0.86 GAA (0.54) GAAKMT2AMEN1CYP1A2CYP2C9
SCHEMBL29609501 0.86 GAA (0.54) GAAKMT2AMEN1CYP1A2CYP2C9
SCHEMBL20560119 0.86 GAA (0.54) GAAKMT2AMEN1CYP1A2CYP2C9
SCHEMBL21049194 0.86 GAA (0.57) GAAKMT2AMEN1CYP1A2CYP2C9
Methane SCHEMBL28345434 0.86 GAA (0.54) GAAKMT2AMEN1CYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100494277-C Polyurethane damping material containing hindered phenol and preparation method thereof UNIV BEIJING CHEMICAL (CN) 2009-06-03 CN claimed
CN-101085861-A Polyurethane damping material containing hindered phenol and preparation method thereof UNIV BEIJING CHEMICAL (CN) 2007-12-12 CN claimed
EP-0421928-B1 Hydroxyphenylcarboxylic acid esters as stabilizers CIBA GEIGY AG (CH) 1994-06-15 EP claimed
US-5177246-A Hydroxphenylcarboxylic acid esters as stabilizers CIBA-GEIGY CORPORATION (US) 1993-01-05 US claimed
EP-0421928-A2 Hydroxyphenylcarboxylic acid esters as stabilizers CIBA-GEIGY AG (CH) 1991-04-10 EP claimed
CN-100494277-C Polyurethane damping material containing hindered phenol and preparation method thereof UNIV BEIJING CHEMICAL (CN) 2009-06-03 CN disclosed
US-20090111699-A1 Weakly Basic Hindered Amines Having Carbonate Skeletons, Synthetic Resin Compositions, And Coating Compositions ADEKA CORPORATION (JP) 2009-04-30 US disclosed
CN-101085861-A Polyurethane damping material containing hindered phenol and preparation method thereof UNIV BEIJING CHEMICAL (CN) 2007-12-12 CN disclosed
EP-0505110-B1 Hydrogenated vinyl aromatic hydrocarbon polymer composition and optical disc substrate MITSUBISHI CHEM CORP (JP) 1996-08-14 EP disclosed
EP-0573393-B1 Perfluoroalkyl substituted hydroxyphenylalkanoic ester antioxidants CIBA GEIGY AG (CH) 1995-12-06 EP disclosed
US-5397821-A Light and heat stabilizers, low volatility ELFATOCHEM NORTH AMERICA, INC. (US) 1995-03-14 US disclosed
US-5338853-A N-(2,2,6,6-tetraalkyl-4-piperidinyl)amic acid hydrazides; contain light stabilizing group and heat stabilizing group ELF ATOCHEM NORTH AMERICA, INC. (US) 1994-08-16 US disclosed
US-5310773-A Protection against oxidative and thermal degradation of polypropylene CIBA-GEIGY CORPORATION (US) 1994-05-10 US disclosed
EP-0573393-A1 Perfluoroalkyl substituted hydroxyphenylalkanoic ester antioxidants CIBA-GEIGY AG (CH) 1993-12-08 EP disclosed
EP-0434080-A1 Derivatives of N-hals-substituted amic acid hydrazides ELF ATOCHEM NORTH AMERICA, INC. (US) 1991-06-26 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 (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-20090111699-A1 Weakly Basic Hindered Amines Having Carbonate Skeletons, Synthetic Resin Compositions, And Coating Compositions H1-2, H1-3, H1-4 GAA 1249/4885KMT2A 162/4885MEN1 1061/4885

“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.