SCHEMBL5711297

SCHEMBL5711297

NC(CCCCc1ccccc1)(C(=O)O)C(=O)OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 2/20 0.48
GRM3 Q14832 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.46
HIF1A Q16665 1/20 0.46
LMNA P02545 2/20 0.45
ALDH1A1 P00352 3/20 0.42
MAPK1 P28482 2/20 0.41
SLC6A3 Q01959 2/20 0.41
MAPT P10636 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SLC6A2 P23975 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
LTB4R Q15722 1/20 0.41
FAAH O00519 2/20 0.40
CES1 P23141 2/20 0.40
HDAC3 O15379 1/20 0.40
ADRA1A P35348 1/20 0.40
HDAC4 P56524 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
SCHEMBL27583508 0.90 SMN1; SMN2 (0.50) GRM2GRM3SMN1; SMN2HIF1ALMNA
SCHEMBL1167642 0.89 SMN1; SMN2 (0.46) SMN1; SMN2HIF1ALMNAALDH1A1MAPK1
SCHEMBL1167641 0.89 SMN1; SMN2 (0.46) SMN1; SMN2HIF1ALMNAALDH1A1MAPK1
SCHEMBL10855143 0.87 SMN1; SMN2 (0.47) SMN1; SMN2HIF1ALMNAALDH1A1MAPK1
SCHEMBL27484782 0.87 SMN1; SMN2 (0.47) SMN1; SMN2HIF1ALMNAALDH1A1MAPK1
SCHEMBL10855149 0.87 SMN1; SMN2 (0.47) SMN1; SMN2HIF1ALMNAALDH1A1MAPK1
SCHEMBL5033585 0.86 ALDH1A1 (0.46) SMN1; SMN2HIF1ALMNAALDH1A1MAPK1
SCHEMBL2963546 0.86 CETP (0.48) SMN1; SMN2HIF1AALDH1A1MAPK1L3MBTL1
SCHEMBL8674203 0.86 CETP (0.48) SMN1; SMN2HIF1AALDH1A1MAPK1L3MBTL1
SCHEMBL149592 0.86 ALDH1A1 (0.49) SMN1; SMN2HIF1ALMNAALDH1A1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1103560-B1 NOVEL THIAZOLIDINE DERIVATIVES SANTEN PHARMACEUTICAL CO LTD (JP) 2006-12-27 EP disclosed