SCHEMBL7606757

SCHEMBL7606757

CNC1=CC(=O)C=CC1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ERBB2 P04626 1/20 0.41
▸ TDP1 Q9NUW8 3/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ RECQL P46063 2/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ HPGD P15428 1/20 0.40
▸ ALOX12 P18054 1/20 0.40
▸ MAOA P21397 4/20 0.35
▸ MAOB P27338 4/20 0.35
▸ ACHE P22303 2/20 0.35
▸ MAPK1 P28482 2/20 0.35
▸ BCHE P06276 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ APEX1 P27695 1/20 0.35
▸ CASP1 P29466 1/20 0.35
▸ BLM P54132 1/20 0.35
▸ MDM2 Q00987 1/20 0.35
▸ DHODH Q02127 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
SCHEMBL11658096 0.77 DNM1 (0.37) —
SCHEMBL28647073 0.76 TDP1 (0.48) ERBB2TDP1ALDH1A1RECQLMEN1
SCHEMBL16887861 0.74 ALDH1A1 (0.40) ERBB2TDP1ALDH1A1RECQLMEN1
SCHEMBL27594442 0.74 TDP1 (0.40) ERBB2TDP1ALDH1A1RECQLMEN1
SCHEMBL9134809 0.74 ALDH1A1 (0.40) ERBB2TDP1ALDH1A1RECQLMEN1
SCHEMBL21814436 0.73 ACHE (0.38) ERBB2TDP1ALDH1A1RECQLMEN1
SCHEMBL21814428 0.70 ACHE (0.40) ERBB2TDP1ALDH1A1RECQLMEN1
SCHEMBL27992527 0.70 ALDH1A1 (0.37) ERBB2TDP1ALDH1A1RECQLMEN1
SCHEMBL21646080 0.69 MAOA (0.49) ERBB2TDP1ALDH1A1RECQLMEN1
SCHEMBL15630516 0.69 ALDH1A1 (0.36) ERBB2TDP1ALDH1A1RECQLMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3856792-A1 AMINO-QUINONE ANTIPOLYMERANTS AND METHODS OF USING Ecolab USA, Inc. (US) 2021-08-04 — — EP claimed
CN-112739725-A Amino quinone anti-polymerization agents and methods of use thereof 埃科莱布美国股份有限公司 2021-04-30 — — CN claimed
WO-2020068735-A1 AMINO-QUINONE ANTIPOLYMERANTS AND METHODS OF USING ECOLAB USA INC. (US) 2020-04-02 — — WO claimed
US-20200102408-A1 AMINO-QUINONE ANTIPOLYMERANTS AND METHODS OF USING ECOLAB USA INC. 2020-04-02 — — US claimed
CN-106146367-B Allyl sulfenyl amino 1,4-benzoquinone class compound, it is prepared and application 北京大学 2017-12-26 — — CN claimed
JP-2002504529-A — — 2002-02-12 — — JP claimed
EP-1060160-A2 DISUBSTITUTED LAVENDUSTIN A ANALOGS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE ANALOGS THE UNITED STATES GOVERNMENT as represented by THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2000-12-20 — — EP claimed
WO-1999043636-A2 DISUBSTITUTED LAVENDUSTIN A ANALOGS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE ANALOGS THE UNITED STATES OF AMERICA AS REPRESENTED BY THESECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1999-09-02 — — WO claimed
CN-112739725-B Amino quinone anti-polymerization agent and method of use thereof 埃科莱布美国股份有限公司 2023-09-26 — — CN disclosed
US-11312793-B2 Amino-quinone antipolymerants and methods of using ECOLAB USA INC. (US) 2022-04-26 — — US disclosed
EP-3856792-A1 AMINO-QUINONE ANTIPOLYMERANTS AND METHODS OF USING Ecolab USA, Inc. (US) 2021-08-04 — — EP disclosed
CN-112739725-A Amino quinone anti-polymerization agents and methods of use thereof 埃科莱布美国股份有限公司 2021-04-30 — — CN disclosed
US-20200102408-A1 AMINO-QUINONE ANTIPOLYMERANTS AND METHODS OF USING ECOLAB USA INC. 2020-04-02 — — US disclosed
WO-2020068735-A1 AMINO-QUINONE ANTIPOLYMERANTS AND METHODS OF USING ECOLAB USA INC. (US) 2020-04-02 — — WO disclosed
CN-100368087-C Nonmetal composite catalytic system consisting of organic matter and use thereof DALIAN CHEMICAL PHYSICS INST (CN) 2008-02-13 — — CN disclosed
CN-1259392-C Nonmetal composite catalytic system for selectively catalytic oxidation of olefin DALIAN CHEMICAL PHYSICS INST (CN) 2006-06-14 — — CN disclosed
CN-1680037-A Nonmetal composite catalytic system consisting of organic matter and use thereof DALIAN CHEMICAL PHYSICS INST (CN) 2005-10-12 — — CN disclosed
CN-1670130-A Nonmetal composite catalytic system for selectively catalytic oxidation of olefin DALIAN CHEMICAL PHYSICS INST (CN) 2005-09-21 — — CN disclosed
US-6399631-B1 3-AMIDO OR 3-SULFONAMIDO; EATING DISORDERS IN HUMANS, DOGS AND CATS PFIZER INC. 2002-06-04 — — US disclosed
EP-0324847-A1 PREPARATION OF BIS (AMINE-CONTAINING) BENZENEDIOLS THE DOW CHEMICAL COMPANY (US) 1989-07-26 — — EP disclosed
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