SCHEMBL7058581

SCHEMBL7058581

CCOC(=O)C(/C=N\O)CCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.49
MAPT P10636 1/20 0.45
MMP8 P22894 1/20 0.43
ACE P12821 2/20 0.42
PIN1 Q13526 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
TDP1 Q9NUW8 1/20 0.40
TSHR P16473 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
NPC1 O15118 1/20 0.40
LMNA P02545 1/20 0.40
F10 P00742 1/20 0.40
CTSL P07711 1/20 0.40
ALDH1A1 P00352 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
SCHEMBL7642345 0.92 SMN1; SMN2 (0.44) SMN1; SMN2MAPTMMP8TDP1LMNA
SCHEMBL7644765 0.91 SMN1; SMN2 (0.43) SMN1; SMN2MAPTMMP8TDP1
SCHEMBL7638998 0.89 SMN1; SMN2 (0.42) SMN1; SMN2MAPTMMP8TDP1
SCHEMBL7642096 0.89 SMN1; SMN2 (0.42) SMN1; SMN2MAPTMMP8TDP1
SCHEMBL7057056 0.89 ALDH1A1 (0.43) SMN1; SMN2L3MBTL1TDP1TSHRLMNA
SCHEMBL7058744 0.87 HCAR2 (0.48) SMN1; SMN2MAPTL3MBTL1TDP1TSHR
SCHEMBL7060200 0.87 GAA (0.49) SMN1; SMN2MAPTL3MBTL1TSHRMEN1
SCHEMBL7061544 0.87 ALDH1A1 (0.44) L3MBTL1TDP1KMT2ALMNACTSL
SCHEMBL7062410 0.87 CTSK (0.48) L3MBTL1TDP1TSHRMEN1KMT2A
SCHEMBL7055592 0.86 ALDH1A1 (0.45) SMN1; SMN2TSHRMEN1KMT2ACTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0937703-B1 METHOD FOR PURIFYING PYRUVIC ACID COMPOUNDS SUMITOMO CHEMICAL CO (JP) 2003-05-21 EP disclosed
US-6348617-B1 REACTING PYRUVIC ACID COMPOUND IN WATER WITH AMMONIUM OR ALKALI METAL BISULFITE TO GIVE AQUEOUS SOLUTION OF BISULFITE ADDUCT, ISOLATING BY PHASE SEPARATION, OPTIONALLY USING HYDROPHOBIC SOLVENT, CONTACTING WITH ACID TO DECOMPOSE ADDUCT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-02-19 US disclosed
EP-0937703-A1 METHOD FOR PURIFYING PYRUVIC ACID COMPOUNDS SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1999-08-25 EP disclosed