SCHEMBL8771313

SCHEMBL8771313

COc1ccccc1C(O)CC(=O)O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.57
L3MBTL1 Q9Y468 2/20 0.57
HTT P42858 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57
SMN1; SMN2 Q16637 2/20 0.51
LMNA P02545 2/20 0.49
CTSA P10619 2/20 0.46
KMT2A Q03164 2/20 0.46
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
RAB9A P51151 1/20 0.43
GLA P06280 1/20 0.43
KDM4E B2RXH2 1/20 0.43
CYP1A2 P05177 1/20 0.43
MEN1 O00255 1/20 0.43
HPGD P15428 1/20 0.43

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
SCHEMBL27574663 0.87 POLB (0.54) POLBL3MBTL1HTTNPSR1SMN1; SMN2
SCHEMBL27574662 0.87 POLB (0.54) POLBL3MBTL1HTTNPSR1SMN1; SMN2
SCHEMBL14690869 0.85 POLB (0.50) POLBL3MBTL1HTTNPSR1SMN1; SMN2
SCHEMBL8770909 0.84 HTT (0.51) POLBL3MBTL1HTTNPSR1SMN1; SMN2
SCHEMBL18150761 0.84 POLB (0.73) POLBL3MBTL1HTTNPSR1SMN1; SMN2
SCHEMBL30781902 0.84 POLB (0.73) POLBL3MBTL1HTTNPSR1SMN1; SMN2
SCHEMBL1207026 0.82 POLB (0.57) POLBL3MBTL1HTTNPSR1SMN1; SMN2
SCHEMBL30040417 0.82 POLB (0.57) POLBL3MBTL1HTTNPSR1SMN1; SMN2
SCHEMBL6387359 0.81 POLB (0.55) POLBL3MBTL1HTTNPSR1SMN1; SMN2
SCHEMBL5720914 0.81 POLB (0.55) POLBL3MBTL1HTTNPSR1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015097123-A1 NEW THIENOPYRIMIDINE DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM LES LABORATOIRES SERVIER (FR) 2015-07-02 WO disclosed
EP-0451668-B1 Process for the production of optically active alkyl 3-aryl-3-hydroxypropionates CHISSO CORP (JP) 1997-08-13 EP disclosed
US-5202457-A Enzyme catalyzed transesterification, resolution of optical active alkyl 3-aryl-3-hydroxypropionate CHISSO CORPORATION (JP) 1993-04-13 US disclosed
EP-0451668-A2 Optically active alkyl 3-aryl-3-hydroxypropionates and a method for producing thereof CHISSO CORPORATION (JP) 1991-10-16 EP disclosed