SCHEMBL7972017

SCHEMBL7972017

CCCCCCCOc1ccc(-c2nc(-c3ccc(OCCCCCCC)cc3O)nc(-c3ccc(OCCCCCCC)cc3O)n2)c(O)c1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.60
LTA4H P09960 2/20 0.53
MEN1 O00255 1/20 0.52
NPC1 O15118 1/20 0.52
ALDH1A1 P00352 1/20 0.52
GAA P10253 1/20 0.52
MAPT P10636 1/20 0.52
RAB9A P51151 1/20 0.52
KMT2A Q03164 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
PTPN11 Q06124 3/20 0.51
CNR2 P34972 2/20 0.50
TP53 P04637 1/20 0.50
TSHR P16473 1/20 0.50
PLA2G4B P0C869 1/20 0.49

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
SCHEMBL14814837 1.00 NR5A1 (0.60) NR5A1LTA4HMEN1NPC1ALDH1A1
SCHEMBL77484 1.00 NR5A1 (0.60) NR5A1LTA4HMEN1NPC1ALDH1A1
SCHEMBL29364526 1.00 NR5A1 (0.60) NR5A1LTA4HMEN1NPC1ALDH1A1
SCHEMBL29502758 1.00 NR5A1 (0.60) NR5A1LTA4HMEN1NPC1ALDH1A1
SCHEMBL999167 1.00 NR5A1 (0.60) NR5A1LTA4HMEN1NPC1ALDH1A1
SCHEMBL29502795 1.00 NR5A1 (0.60) NR5A1LTA4HMEN1NPC1ALDH1A1
SCHEMBL8038263 0.96 NR5A1 (0.59) NR5A1LTA4HMEN1NPC1ALDH1A1
SCHEMBL13021253 0.95 NPC1 (0.56) NR5A1LTA4HMEN1NPC1ALDH1A1
SCHEMBL23577081 0.93 NR5A1 (0.53) NR5A1LTA4HMEN1NPC1ALDH1A1
SCHEMBL7982412 0.93 NR5A1 (0.53) NR5A1LTA4HMEN1NPC1ALDH1A1

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-6184375-B1 STABILIZERS FOR ORGANIC MATERIAL AGAINST THE DAMAGING EFFECT OF LIGHT, OXYGEN AND HEAT; SKIN OR HAIR PROTECTION PREPARATIONS. CIBA SPECIALTY CHEMICALS CORPORATION 2001-02-06 US claimed