SCHEMBL8909141

SCHEMBL8909141

CCCCCCOc1ccc(-c2nc(-c3ccc(OCCCCCC)cc3O)nc(-c3c(C)cc(C)cc3C)n2)c(O)c1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.48
NPC1 O15118 2/20 0.43
GAA P10253 2/20 0.43
MAPT P10636 2/20 0.43
RAB9A P51151 2/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
KMT2A Q03164 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PTPN11 Q06124 3/20 0.43
LTA4H P09960 1/20 0.43
CNR2 P34972 2/20 0.42
THRA P10827 2/20 0.42
THRB P10828 1/20 0.42
TP53 P04637 2/20 0.41
LMNA P02545 1/20 0.41
ALOX15 P16050 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL8385528 0.95 NR5A1 (0.44) NR5A1NPC1GAAMAPTRAB9A
SCHEMBL30887235 0.95 NR5A1 (0.44) NR5A1NPC1GAAMAPTRAB9A
SCHEMBL31582510 0.90 PDK2 (0.38) NR5A1NPC1GAAPTPN11CNR2
SCHEMBL8387404 0.90 NR5A1 (0.39) NR5A1PTPN11CNR2THRATHRB
SCHEMBL45412 0.89 NR5A1 (0.49) NR5A1NPC1GAAMAPTRAB9A
SCHEMBL3893045 0.89 NR5A1 (0.49) NR5A1NPC1GAAMAPTRAB9A
SCHEMBL38944 0.89 NR5A1 (0.49) NR5A1NPC1GAAMAPTRAB9A
SCHEMBL22216823 0.89 NR5A1 (0.49) NR5A1NPC1GAAMAPTRAB9A
SCHEMBL78927 0.89 NR5A1 (0.49) NR5A1NPC1GAAMAPTRAB9A
SCHEMBL1309485 0.89 NR5A1 (0.49) NR5A1NPC1GAAMAPTRAB9A

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
US-5686233-A PHOTOGRAPHIC FILM STABILIZER CIBA-GEIGY CORPORATION (US) 1997-11-11 US disclosed