SCHEMBL8657246

SCHEMBL8657246

CCOC(=O)C(N)=C(Cl)C(=O)OCC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.48
ALDH1A1 P00352 6/20 0.40
MAPT P10636 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
GLO1 Q04760 1/20 0.39
LMNA P02545 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CYP1A2 P05177 2/20 0.38
TSHR P16473 1/20 0.38
MGAM O43451 1/20 0.37
GAA P10253 1/20 0.37
SI P14410 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37
SOAT1 P35610 1/20 0.37
EGLN1 Q9GZT9 1/20 0.36
TRPA1 O75762 1/20 0.34
CYP2D6 P10635 1/20 0.34

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
SCHEMBL8657241 1.00 ALOX15 (0.48) ALOX15ALDH1A1MAPTMEN1KMT2A
SCHEMBL9842483 1.00 ALOX15 (0.48) ALOX15ALDH1A1MAPTMEN1KMT2A
SCHEMBL11146185 0.83 ALDH1A1 (0.50) ALOX15ALDH1A1MAPTMEN1KMT2A
SCHEMBL14536877 0.83 ALOX15 (0.60) ALOX15ALDH1A1MAPTMEN1KMT2A
SCHEMBL9572187 0.83 ALDH1A1 (0.50) ALOX15ALDH1A1MAPTMEN1KMT2A
SCHEMBL9572183 0.83 ALDH1A1 (0.50) ALOX15ALDH1A1MAPTMEN1KMT2A
SCHEMBL9720615 0.83 LMNA (0.38) ALOX15ALDH1A1LMNAHSD17B10TSHR
SCHEMBL9720620 0.83 LMNA (0.38) ALOX15ALDH1A1LMNAHSD17B10TSHR
SCHEMBL9073790 0.82 ALOX15 (0.48) ALOX15ALDH1A1MAPTMEN1KMT2A
SCHEMBL9073787 0.82 ALOX15 (0.48) ALOX15ALDH1A1MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-5840904-A Fluoro-pyridine-2,3-dicarboxylic anhydrides which are intermediates for herbicidal pyridine-2,3-dicarboximides BASF AKTIENGESELLSCHAFT (DE) 1998-11-24 US disclosed
US-5679622-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1997-10-21 US disclosed
US-5101067-A Chemical intermediates for pyridinedicarboxylic acid esters, herbicides WACKER-CHEMIE GMBH (DE) 1992-03-31 US disclosed
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 disclosed
US-5008392-A Reacting 2,3-dihalomaleic acid esters with ammonia or salts, reacting product with alpha, B-unsaturated aldehydes or ketones WACKER-CHEMIE GMBH (DE) 1991-04-16 US disclosed