SCHEMBL327206

SCHEMBL327206

CCCCCOCC(=O)NC(CC(=O)O)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.57
POLB P06746 1/20 0.47
GPR88 Q9GZN0 2/20 0.46
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
LMNA P02545 1/20 0.44
ITGB3 P05106 3/20 0.43
ITGA2B P08514 3/20 0.43
ALDH1A1 P00352 3/20 0.43
ITGAV P06756 1/20 0.43
ITGB5 P18084 1/20 0.43
ITGB6 P18564 1/20 0.43
TSHR P16473 1/20 0.43
ASAH1 Q13510 1/20 0.42
ACER2 Q5QJU3 1/20 0.42

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
SCHEMBL27758299 0.82 ASAH1 (0.60) SMN1; SMN2ITGB3ITGA2BALDH1A1ITGAV
SCHEMBL6569363 0.82 LPAR5 (0.45) SMN1; SMN2GPR88NPC1RAB9ALMNA
SCHEMBL6570210 0.82 ALDH1A1 (0.43) SMN1; SMN2GPR88NPC1RAB9ALMNA
SCHEMBL4127562 0.82 POLB (0.53) SMN1; SMN2POLBNPC1RAB9ALMNA
SCHEMBL4127567 0.82 POLB (0.53) SMN1; SMN2POLBNPC1RAB9ALMNA
SCHEMBL9829985 0.81 SMN1; SMN2 (0.57) SMN1; SMN2ITGB3ITGA2BALDH1A1ITGAV
SCHEMBL2249845 0.79 TSHR (0.67) SMN1; SMN2POLBLMNAITGB3ITGA2B
SCHEMBL6857593 0.79 SMN1; SMN2 (0.64) SMN1; SMN2POLBLMNAITGB3ITGA2B
SCHEMBL6967716 0.79 SMN1; SMN2 (0.49) SMN1; SMN2POLBITGB3ITGA2BALDH1A1
SCHEMBL9829245 0.78 SMN1; SMN2 (0.60) SMN1; SMN2POLBLMNAITGB3ITGA2B

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-2590931-A1 (2-ARYLOXY-ACETYLAMINO)-PHENYL-PROPIONIC ACID DERIVATIVES, METHOD FOR PRODUCING SAME AND USE THEREOF AS PHARMACEUTICALS SANOFI (FR) 2013-05-15 EP disclosed
CN-103080073-A (2-Aryloxyacetylamino) phenyl-propionic acid derivatives, method for the production thereof and use thereof as medicaments SANOFI SA 2013-05-01 CN disclosed
WO-2012004269-A1 (2-ARYLOXY-ACETYLAMINO)-PHENYL-PROPIONIC ACID DERIVATIVES, METHOD FOR PRODUCING SAME AND USE THEREOF AS PHARMACEUTICALS SANOFI (FR) 2012-01-12 WO disclosed