SCHEMBL69488

SCHEMBL69488

CCc1cc(O)c(O)cc1C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.52
ALOX12 P18054 2/20 0.52
TRPA1 O75762 1/20 0.41
ESR1 P03372 6/20 0.41
ESR2 Q92731 4/20 0.41
KDM4E B2RXH2 3/20 0.40
MAPT P10636 3/20 0.40
ALDH1A1 P00352 2/20 0.40
MAPK1 P28482 2/20 0.40
MCL1 Q07820 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
NOS3 P29474 1/20 0.40
NOS1 P29475 1/20 0.40
NOS2 P35228 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
G6PD P11413 1/20 0.40
CYP2C9 P11712 1/20 0.40
PKM P14618 1/20 0.40

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
SCHEMBL16122784 0.87 ALOX15 (0.45) ALOX15ALOX12ESR1ESR2KDM4E
SCHEMBL11076422 0.87 NPSR1 (0.50) ALOX15ALOX12ESR1ESR2KDM4E
SCHEMBL45886 0.87 MCL1 (0.47) ALOX15ALOX12ESR1ESR2KDM4E
SCHEMBL14395025 0.87 MCL1 (0.47) ALOX15ALOX12ESR1ESR2KDM4E
SCHEMBL30979259 0.87 ALOX15 (0.45) ALOX15ALOX12ESR1ESR2KDM4E
SCHEMBL5676149 0.83 ALOX15 (0.68) ALOX15ALOX12TRPA1ESR1ESR2
SCHEMBL9231605 0.82 KDM4E (0.50) ALOX15ALOX12ESR1ESR2KDM4E
SCHEMBL23652953 0.81 HPGD (0.42) ALOX15ALOX12ESR1ESR2KDM4E
SCHEMBL18179319 0.81 ALOX15 (0.41) ALOX15ALOX12ESR1ESR2KDM4E
SCHEMBL22198722 0.81 MCL1 (0.40) ALOX15ALOX12ESR1ESR2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017178513-A1 PRODUCTION OF MONOMERS FROM LIGNIN DURING DEPOLYMERISATION OF LIGNOCELLULOSE-CONTAINING COMPOSITION ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2017-10-19 WO disclosed
EP-2705550-B1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2017-07-05 EP disclosed
US-8911831-B2 Surface independent, surface-modifying, multifunctional coatings and applications thereof NORTHWESTERN UNIVERSITY (US) 2014-12-16 US disclosed
US-8541060-B2 coating an alkaline solution comprising 3,4-dihydroxy-L-phenylalanine, dopamine, norepinephrine or epinephrine; coupling the metal, or proteins, or nucleic acids; silver metal layer formed on polydopamine-coated silicon nitride; anti-biofouling on medical device catheters, stents or semiconductor sensors NORTHWESTERN UNIVERSITY (US) 2013-09-24 US disclosed
EP-2479203-A1 AROMATIC POLYESTER Muroran Institute of Technology (JP) 2012-07-25 EP disclosed
US-20120172570-A1 AROMATIC POLYESTER NITTA CORPORATION 2012-07-05 US disclosed
US-8129493-B2 Aromatic polyester MURORAN INSTITUTE OF TECHNOLOGY (JP) 2012-03-06 US disclosed
US-20110224343-A1 MODIFIER FOR AROMATIC POLYESTER AND AROMATIC POLYESTER RESIN COMPOSITION COMPRISING THE SAME MURORAN INSTITUTE OF TECHNOLOGY (JP) 2011-09-15 US disclosed
US-20110092662-A1 AROMATIC POLYESTER NITTA CORPORATION (JP) 2011-04-21 US disclosed
US-20060036049-A1 Soluble late transition metal catalysts for olefin oligomerizations III ZHAO BAIYI 2006-02-16 US disclosed
EP-1620447-A1 SOLUBLE LATE TRANSITION METAL CATALYSTS FOR OLEFIN OLIGOMERIZATIONS III Exxonmobil Chemical Patents Inc. (US) 2006-02-01 EP disclosed
WO-2003102006-A1 SOLUBLE LATE TRANSITION METAL CATALYSTS FOR OLEFIN OLIGOMERIZATIONS III EXXONMOBIL CHEMICAL PATENTS INC. (US) 2003-12-11 WO 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-20060036049-A1 Soluble late transition metal catalysts for olefin oligomerizations III COMT, CD69, SPR ALOX15 907/4885ALOX12 764/4885TRPA1 1914/4885
US-20110224343-A1 MODIFIER FOR AROMATIC POLYESTER AND AROMATIC POLYESTER RESIN COMPOSITION COMPRISING THE SAME F12, PHAX, WDR82 ALOX15 1966/4885ALOX12 1847/4885TRPA1 150/4885

“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.