SCHEMBL6814814

SCHEMBL6814814

O=C1C=CC(=O)C(=Nc2ccccc2)C1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
MAPT P10636 3/20 0.38
CYP3A4 P08684 2/20 0.38
CYP1A2 P05177 1/20 0.38
GAA P10253 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
GSK3A P49840 1/20 0.37
GSK3B P49841 1/20 0.37
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
IDO1 P14902 2/20 0.33
MAOA P21397 2/20 0.33
MAOB P27338 2/20 0.33
CDC25B P30305 1/20 0.33
AKT1 P31749 1/20 0.33
SNCA P37840 1/20 0.33
MAP2K1 Q02750 1/20 0.33
PIN1 Q13526 1/20 0.33

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
SCHEMBL10887811 0.81 GFER (0.36) MEN1KMT2AMAPTCYP1A2GSK3A
SCHEMBL28970922 0.74 MEN1 (0.42) MEN1KMT2AMAPTCYP3A4GAA
SCHEMBL6152323 0.69 GSK3A (0.46) GSK3AGSK3B
SCHEMBL4586121 0.69 GSK3A (0.46) CYP1A2CYP2C19GSK3AGSK3BCDC25B
SCHEMBL11698307 0.69 GSK3A (0.46) GSK3AGSK3B
SCHEMBL18786507 0.67 ALDH1A1 (0.45) MEN1KMT2AMAPTCYP3A4CYP1A2
SCHEMBL8773373 0.66 FURIN (0.43) MEN1KMT2AMAPTCYP3A4CYP1A2
SCHEMBL8773370 0.66 FURIN (0.43) MEN1KMT2AMAPTCYP3A4CYP1A2
SCHEMBL19847083 0.65 GSK3A (0.37) GSK3AGSK3B
SCHEMBL10481663 0.64 BCHE (0.47) MEN1KMT2AMAPTCYP3A4CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107573276-B Synthetic method of 3-ethyl-5-hydroxy-1, 3-diaryl indolone 西北大学 2020-06-09 CN claimed
EP-1047667-B1 PREPARATION OF N-PHENYL-BENZOQUINONEIMINE FROM HYDROXYDIPHENYLAMINES FLEXSYS AMERICA LP (US) 2003-07-02 EP claimed
US-6222080-B1 PROVIDING A VINYL AROMATIC COMPOUND; FORMING MIXTURE BY ADDING POLYMERIZATION INHIBITOR WHICH COMPRISES AN N-PHENYL-1,4-BENZOQUINONEIMINE COMPOUND; DISTILLING MIXTURE UNIROYAL CHEMICAL COMPANY, INC. 2001-04-24 US claimed
US-6039895-A N-PHENYL-1,4-BENZOQUINONEIMINE ADDIVANT USA, LLC 2000-03-21 US claimed
EP-0553210-B1 A polymerisation inhibitor system comprising air and a N-phenyl-1,4-benzoquinoneimine compound UNIROYAL CHEM CO INC (US) 1995-07-19 EP claimed
EP-0553210-A1 BENZOQUINONEIMINES AS VINYL AROMATIC POLYMERIZATION INHIBITORS. UNIROYAL CHEM CO INC (US) 1993-08-04 EP claimed
US-5189218-A PREPARATION OF N-PHENYLBENZOQUINONE-IMINE AND CONVERTING SAME INTO P-PHENYLENEDIAMINES RHONE-POULENC CHIMIE (FR) 1993-02-23 US claimed
WO-1992006939-A1 BENZOQUINONEIMINES AS VINYL AROMATIC POLYMERIZATION INHIBITORS UNIROYAL CHEMICAL COMPANY, INC. (US) 1992-04-30 WO claimed
JP-4235151-A None JP disclosed
CN-107573276-B Synthetic method of 3-ethyl-5-hydroxy-1, 3-diaryl indolone 西北大学 2020-06-09 CN disclosed
EP-1030833-B1 PREPARATION OF QUINONEDIIMINES FROM PHENYLENEDIAMINES USING A HYPOCHLORITE AS AN OXIDATION AGENT FLEXSYS AMERICA LP (US) 2004-02-18 EP disclosed
EP-1027327-B1 FORMATION OF QUINONEDIIMINES FROM PHENYLENEDIAMINES BY CATALYTIC OXIDATION FLEXSYS AMERICA LP (US) 2003-09-03 EP disclosed
EP-1047667-B1 PREPARATION OF N-PHENYL-BENZOQUINONEIMINE FROM HYDROXYDIPHENYLAMINES FLEXSYS AMERICA LP (US) 2003-07-02 EP disclosed
EP-1042269-B1 PREPARATION OF QUINONEDIIMINES FROM PHENYLENEDIAMINES USING HYDROGEN PEROXIDE AND A CATALYST FLEXSYS AMERICA LP (US) 2003-05-02 EP disclosed
US-5189218-A PREPARATION OF N-PHENYLBENZOQUINONE-IMINE AND CONVERTING SAME INTO P-PHENYLENEDIAMINES RHONE-POULENC CHIMIE (FR) 1993-02-23 US disclosed
US-5189218-A PREPARATION OF N-PHENYLBENZOQUINONE-IMINE AND CONVERTING SAME INTO P-PHENYLENEDIAMINES RHONE-POULENC CHIMIE (FR) 1993-02-23 US disclosed
JP-H04235151-A PREPARATION OF N-PHENYLBENZOQUINONE-IMINE RHONE POULENC CHIM 1992-08-24 JP disclosed
WO-1992006939-A1 BENZOQUINONEIMINES AS VINYL AROMATIC POLYMERIZATION INHIBITORS UNIROYAL CHEMICAL COMPANY, INC. (US) 1992-04-30 WO disclosed
WO-1992006939-A1 BENZOQUINONEIMINES AS VINYL AROMATIC POLYMERIZATION INHIBITORS UNIROYAL CHEMICAL COMPANY, INC. (US) 1992-04-30 WO disclosed
EP-0452168-A1 Process for the preparation of N-phenyl benzoquinone-imine RHONE-POULENC CHIMIE (FR) 1991-10-16 EP disclosed