SCHEMBL433389

SCHEMBL433389

CCOC(=O)C(=O)NC(Cc1ccccc1)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.60
L3MBTL1 Q9Y468 1/20 0.56
MME P08473 3/20 0.52
ACE P12821 2/20 0.52
CPA1 P15085 2/20 0.52
ACE2 Q9BYF1 2/20 0.52
NPSR1 Q6W5P4 1/20 0.51
LMNA P02545 2/20 0.51
NAALAD2 Q9Y3Q0 1/20 0.50
FPR2 P25090 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
MMP8 P22894 1/20 0.50
TSHR P16473 1/20 0.49
POLB P06746 1/20 0.49

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
SCHEMBL15450545 0.90 POLB (0.61) SMN1; SMN2L3MBTL1LMNATSHRPOLB
SCHEMBL4221139 0.86 TGFBR1 (0.57) L3MBTL1MMEACECPA1ACE2
SCHEMBL13878717 0.86 TGFBR1 (0.57) L3MBTL1MMEACECPA1ACE2
SCHEMBL15488024 0.86 SMN1; SMN2 (0.49) SMN1; SMN2L3MBTL1MMEACECPA1
SCHEMBL3769914 0.85 L3MBTL1 (0.58) L3MBTL1MMEACECPA1ACE2
SCHEMBL996291 0.85 L3MBTL1 (0.58) L3MBTL1MMEACECPA1ACE2
SCHEMBL996293 0.85 L3MBTL1 (0.58) L3MBTL1MMEACECPA1ACE2
Hydrochloric Acid SCHEMBL28046933 0.84 L3MBTL1 (0.57) L3MBTL1MMEACECPA1ACE2
Hydrochloric Acid SCHEMBL27371193 0.84 L3MBTL1 (0.57) L3MBTL1MMEACECPA1ACE2
SCHEMBL13878718 0.81 ACE (0.60) L3MBTL1MMEACEACE2NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2595994-A2 PROCESS FOR PREPARING PYRANO - [2,3-C]PYRIDINE DERIVATIVES Glaxo Group Limited (GB) 2013-05-29 EP disclosed
WO-2012012391-A2 PROCESS FOR PREPARING PYRANO - [2,3-C]PYRIDINE DERIVATIVES GLAXO GROUP LIMITED (GB) 2012-01-26 WO disclosed