SCHEMBL8935913

SCHEMBL8935913

CCC(Oc1ccc2ccccc2c1)C(=O)O

nearest known ligand 0.77

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARG P37231 12/20 0.77
PPARA Q07869 12/20 0.77
SMN1; SMN2 Q16637 1/20 0.64
PTPN7 P35236 1/20 0.51
AKR1C3 P42330 3/20 0.48
AKR1C2 P52895 3/20 0.48
AKR1C1 Q04828 1/20 0.48
PTGS1 P23219 1/20 0.48
RAB9A P51151 1/20 0.48
MEN1 O00255 1/20 0.47
MAPT P10636 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.47

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
SCHEMBL8935921 1.00 PPARG (0.77) PPARGPPARASMN1; SMN2PTPN7AKR1C3
SCHEMBL30559867 1.00 PPARG (0.77) PPARGPPARASMN1; SMN2PTPN7AKR1C3
SCHEMBL11094172 0.86 PPARG (0.62) PPARGPPARASMN1; SMN2AKR1C3AKR1C2
SCHEMBL2222030 0.86 SMN1; SMN2 (0.59) PPARGPPARASMN1; SMN2PTPN7AKR1C3
SCHEMBL2223492 0.84 SMN1; SMN2 (0.57) PPARGPPARASMN1; SMN2AKR1C3AKR1C2
SCHEMBL2224818 0.84 SMN1; SMN2 (0.57) PPARGPPARASMN1; SMN2AKR1C3AKR1C2
SCHEMBL1565456 0.84 PPARG (0.83) PPARGPPARASMN1; SMN2PTPN7
SCHEMBL4651839 0.84 SMN1; SMN2 (0.64) PPARGPPARASMN1; SMN2ALDH1A1
SCHEMBL295888 0.84 SMN1; SMN2 (0.64) PPARGPPARASMN1; SMN2ALDH1A1
SCHEMBL8315325 0.83 PPARG (0.69) PPARGPPARAPTPN7MEN1MAPT

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
CN-1070487-C Hexahydronaphthalene ester derivatives, their preparation and their therapeutic uses SANKYO CO (JP) 2001-09-05 CN disclosed
US-5491167-A INHIBITORS OF CHOLESTEROL BIOSYNTHESIS SANKYO COMPANY, LIMITED (JP) 1996-02-13 US disclosed
CN-1098099-A The hexahydro naphthalene ester derivative, their preparation and their treatment are used SANKYO CO (JP) 1995-02-01 CN disclosed