SCHEMBL8475294

SCHEMBL8475294

COc1ccc(C(O)C(=O)OC(C(=O)O)c2ccc(OC)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KLK7 P49862 2/20 0.48
POLB P06746 1/20 0.44
MAPT P10636 1/20 0.44
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
GRM8 O00222 1/20 0.44
GRM6 O15303 1/20 0.44
GRM4 Q14833 1/20 0.44
LDHA P00338 1/20 0.44
PTGS2 P35354 3/20 0.43
AKR1C3 P42330 3/20 0.43
AKR1C2 P52895 3/20 0.43
PTGS1 P23219 2/20 0.43
CYP1A2 P05177 2/20 0.43
CDC42 P60953 1/20 0.43
RAC1 P63000 1/20 0.43
TSHR P16473 1/20 0.43
SLC22A6 Q4U2R8 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
SCHEMBL7829228 0.82 NPC1 (0.46) KLK7POLBMAPTMEN1NPC1
SCHEMBL4709268 0.81 MAPK1 (0.52) KLK7POLBMAPTMEN1NPC1
SCHEMBL352389 0.81 LMNA (0.57) KLK7KMT2AALDH1A1
SCHEMBL7262029 0.81 LMNA (0.57) KLK7KMT2AALDH1A1
SCHEMBL4634271 0.81 TSHR (0.56) MAPTNPC1RAB9AGRM8GRM6
SCHEMBL503627 0.81 TSHR (0.56) MAPTNPC1RAB9AGRM8GRM6
SCHEMBL503628 0.81 TSHR (0.56) MAPTNPC1RAB9AGRM8GRM6
SCHEMBL9698724 0.79 KLK7 (0.47) KLK7POLBMAPTMEN1NPC1
SCHEMBL9699876 0.79 KLK7 (0.47) KLK7POLBMAPTMEN1NPC1
SCHEMBL17295989 0.79 LDHA (0.52) POLBMAPTMEN1NPC1RAB9A

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
EP-0929567-A1 IMPROVED SOLID-PHASE PEPTIDE SYNTHESIS AND AGENT FOR USE IN SUCH SYNTHESIS Zealand Pharmaceuticals A/S (DK) 1999-07-21 EP claimed
WO-1998011125-A1 IMPROVED SOLID-PHASE PEPTIDE SYNTHESIS AND AGENT FOR USE IN SUCH SYNTHESIS ZEALAND PHARMACEUTICALS A/S (DK) 1998-03-19 WO claimed
EP-0929567-A1 IMPROVED SOLID-PHASE PEPTIDE SYNTHESIS AND AGENT FOR USE IN SUCH SYNTHESIS Zealand Pharmaceuticals A/S (DK) 1999-07-21 EP disclosed
WO-1998011125-A1 IMPROVED SOLID-PHASE PEPTIDE SYNTHESIS AND AGENT FOR USE IN SUCH SYNTHESIS ZEALAND PHARMACEUTICALS A/S (DK) 1998-03-19 WO disclosed