SCHEMBL2487883

SCHEMBL2487883

O=C(O)c1cc(CCl)cnc1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.40
ALDH1A1 P00352 3/20 0.40
TSHR P16473 2/20 0.40
CYP3A4 P08684 1/20 0.40
MAPT P10636 1/20 0.40
ALOX15 P16050 1/20 0.40
BLM P54132 1/20 0.40
AGER Q15109 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ASPH Q12797 7/20 0.38
KDM8 Q8N371 7/20 0.38
ATM Q13315 1/20 0.36
KLKB1 P03952 1/20 0.35
CTSB P07858 1/20 0.35
MMP9 P14780 1/20 0.35
DNMT1 P26358 1/20 0.35
DNMT3B Q9UBC3 1/20 0.35
DNMT3L Q9UJW3 1/20 0.35
DNMT3A Q9Y6K1 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
Nitric Acid SCHEMBL7048263 0.91 KDM4E (0.34) KDM4EALDH1A1TSHRCYP3A4MAPT
SCHEMBL12224094 0.88 SIRT6 (0.37) KDM4EALDH1A1TSHRASPHKDM8
SCHEMBL9317147 0.86 ALDH1A1 (0.33) KDM4EALDH1A1ASPHKDM8KLKB1
SCHEMBL9315383 0.86 KDM4E (0.38) KDM4EALDH1A1TSHRCYP3A4MAPT
SCHEMBL28281331 0.84 KDM4E (0.38) KDM4EALDH1A1TSHRCYP3A4MAPT
SCHEMBL2486333 0.83 KDM4E (0.41) KDM4EALDH1A1TSHRCYP3A4MAPT
SCHEMBL7052671 0.81 KDM4E (0.40) KDM4EALDH1A1TSHRCYP3A4MAPT
SCHEMBL351540 0.81 GABRP (0.46) KDM4EALDH1A1TSHRCYP3A4MAPT
SCHEMBL7471367 0.81 KDM4E (0.40) KDM4EALDH1A1TSHRCYP3A4MAPT
SCHEMBL3086351 0.80 GABRP (0.45) KDM4EALDH1A1TSHRCYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2376472-A1 PROCESS FOR MANUFACTURING 5-FORMYL-PYRIDINE-2,3-DICARBOXYLIC ACID ESTERS BASF SE (DE) 2011-10-19 EP claimed
WO-2010066668-A1 PROCESS FOR MANUFACTURING 5-FORMYL-PYRIDINE-2,3-DICARBOXYLIC ACID ESTERS BASF SE (DE) 2010-06-17 WO claimed
EP-0601288-B1 Substituted 2,3-dicarboxypyridinium nitrates BASF AG (DE) 2003-05-02 EP claimed
EP-0461402-B1 Process for the preparation of substituted and unsubstituted 2,3-pyridinedicarboxylates from chloromaleate or chlorofumarate or mixtures thereof AMERICAN CYANAMID CO (US) 1998-07-15 EP claimed
CN-1038507-C Process for preparation of substituted and unsubstituted-2,3-pyridinedicarboxylates from chloromaleate or chlorofumarate or mixtures thereof AMERICAN CYANAMID CO (US) 1998-05-27 CN claimed
CN-1038414-C Process for preparation of dialkyl, pyridine-2,3-dicarboxylates and derivatives thereof from dialkyl dichlorosucciate AMERICAN CYANAMID CO (US) 1998-05-20 CN claimed
EP-0461403-B1 Process for the preparation of dialkyl pyridine-2,3-dicarboxylate and derivatives thereof from dialkyl dichlorosucciante AMERICAN CYANAMID CO (US) 1996-08-28 EP claimed
EP-0560019-B1 Process for the preparation of dialkyl 2,3-pyridinedicarboxylate and derivatives thereof from an alpha, beta-unsaturated oxime and an aminobutenedioate AMERICAN CYANAMID CO (US) 1996-04-24 EP claimed
EP-0560019-A1 Process for the preparation of dialkyl 2,3-pyridinedicarboxylate and derivatives thereof from an alpha, beta-unsaturated oxime and an aminobutenedioate AMERICAN CYANAMID COMPANY (US) 1993-09-15 EP claimed
US-5227491-A Process for the preparation of dialkyl 2,3-pyridinedicarboxylate and derivatives thereof from an α,β-unsaturated oxime and an aminobutenedioate AMERICAN CYANAMID COMPANY (US) 1993-07-13 US claimed
US-5225560-A Dehydrohalogenation AMERICAN CYANAMID COMPANY (US) 1993-07-06 US claimed
EP-0548559-A1 Process for the preparation of dialkyl pyridine -2,3-dicarboxylates and derivatives thereof from dialkyl dichloromaleate AMERICAN CYANAMID COMPANY (US) 1993-06-30 EP claimed
CN-1062724-A Replace or do not have replacement-2, the method for 3-pyridine dicarboxylate by chloromaleic acid ester or chlorofumaric acid ester or the preparation of its mixture AMERICAN CYANAMID CO (US) 1992-07-15 CN claimed
US-5124458-A Reacting a dialkyldichlorosuccinate with a dehydrohalogenating agent, treating the reaction product with ammonia, treating the new reaction product with an unsaturated aldehyde or ketone AMERICAN CYANAMID COMPANY (US) 1992-06-23 US claimed
US-5118809-A Mixing with ammonium salt and unsaturated aldehydes or ketones AMERICAN CYANAMID COMPANY (US) 1992-06-02 US claimed
CN-1057455-A Prepare pyridine-2 by dichloro succinate dialkyl ester, the method for 3-dicarboxylic acid dialkyl esters and derivative thereof AMERICAN CYANAMID CO (US) 1992-01-01 CN claimed
CN-1057456-A Prepare pyridine-2 by the dichloro-dialkyl maleate, the method for 3-dicarboxylic acid dialkyl esters and derivative thereof AMERICAN CYANAMID CO (US) 1992-01-01 CN claimed
EP-0461403-A1 Process for the preparation of dialkyl pyridine-2,3-dicarboxylate and derivatives thereof from dialkyl dichlorosucciante AMERICAN CYANAMID COMPANY (US) 1991-12-18 EP claimed
EP-0461401-A1 Process for the preparation of dialkyl, pyridine-2,3-dicarboxylates and derivatives thereof from dialkyl dichloromaleate AMERICAN CYANAMID COMPANY (US) 1991-12-18 EP claimed
EP-0461402-A1 Process for the preparation of substituted and unsubstituted 2,3-pyridinedicarboxylates from chloromaleate or chlorofumarate or mixtures thereof AMERICAN CYANAMID COMPANY (US) 1991-12-18 EP claimed