SCHEMBL8909196

SCHEMBL8909196

Cc1cc(C)c(-c2nc(-c3ccc(OCCCCCC(C)C)cc3O)nc(-c3ccc(OCCCCCC(C)C)cc3O)n2)c(C)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.40
HTR1A P08908 1/20 0.36
HTR1D P28221 1/20 0.36
HTR1B P28222 1/20 0.36
ADRB2 P07550 1/20 0.36
NPC1 O15118 2/20 0.35
CNR2 P34972 3/20 0.33
GAA P10253 2/20 0.33
DPP4 P27487 2/20 0.33
MGAM O43451 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
MAPK1 P28482 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL989628 0.90 RARB (0.41) RARBHTR1AHTR1DHTR1BADRB2
SCHEMBL29466959 0.90 RARB (0.41) RARBHTR1AHTR1DHTR1BADRB2
SCHEMBL13168759 0.89 RARB (0.48) RARBHTR1AHTR1DHTR1BADRB2
SCHEMBL8910174 0.89 ADRB2 (0.34) RARBHTR1AHTR1DHTR1BADRB2
SCHEMBL8909141 0.87 NR5A1 (0.48) NPC1CNR2GAAMEN1ALDH1A1
SCHEMBL31582510 0.87 PDK2 (0.38) NPC1CNR2GAAPDK2NR5A1
SCHEMBL3728973 0.84 RARB (0.39) RARBHTR1AHTR1DHTR1BADRB2
SCHEMBL8387404 0.84 NR5A1 (0.39) CNR2NR5A1
SCHEMBL8385528 0.83 NR5A1 (0.44) NPC1CNR2GAAMEN1ALDH1A1
SCHEMBL30887235 0.83 NR5A1 (0.44) NPC1CNR2GAAMEN1ALDH1A1

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