SCHEMBL8340505

SCHEMBL8340505

CCc1ccc(O)cc1C(=O)c1ccc(OC)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.56
MAPT P10636 5/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
HTT P42858 3/20 0.54
NPSR1 Q6W5P4 1/20 0.54
ALDH1A1 P00352 2/20 0.54
LMNA P02545 1/20 0.54
CYP1A2 P05177 1/20 0.54
PGR P06401 1/20 0.54
CYP2D6 P10635 1/20 0.54
HPGD P15428 1/20 0.54
SLC6A2 P23975 1/20 0.54
PDE4A P27815 1/20 0.54
MAPK1 P28482 1/20 0.54
CYP2C19 P33261 1/20 0.54
HRH1 P35367 1/20 0.54
SLC6A3 Q01959 1/20 0.54
PDE4D Q08499 1/20 0.54
GAA P10253 1/20 0.53
MEN1 O00255 1/20 0.53

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
SCHEMBL93177 0.80 HPGD (0.71) NPC1MAPTSMN1; SMN2HTTALDH1A1
SCHEMBL30374771 0.80 HPGD (0.71) NPC1MAPTSMN1; SMN2HTTALDH1A1
SCHEMBL28520850 0.80 KMT2A (0.64) NPC1MAPTSMN1; SMN2HTTNPSR1
SCHEMBL8340088 0.80 NPC1 (0.61) NPC1MAPTSMN1; SMN2HTTNPSR1
SCHEMBL29415029 0.79 LMNA (0.81) NPC1MAPTSMN1; SMN2HTTNPSR1
SCHEMBL228916 0.79 LMNA (0.81) NPC1MAPTSMN1; SMN2HTTNPSR1
SCHEMBL8338080 0.78 HTT (0.56) NPC1MAPTSMN1; SMN2HTTNPSR1
SCHEMBL29633666 0.78 HPGD (0.68) NPC1MAPTSMN1; SMN2HTTNPSR1
SCHEMBL2486574 0.78 HPGD (0.68) NPC1MAPTSMN1; SMN2HTTNPSR1
SCHEMBL6171166 0.78 HPGD (0.79) NPC1MAPTSMN1; SMN2HTTNPSR1

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
WO-1999007694-A1 COMPOUNDS AND USES THEREOF ELI LILLY AND COMPANY (US) 1999-02-18 WO disclosed