SCHEMBL5147301

SCHEMBL5147301

CCCCOCCCOc1ccc(-c2nc(-c3ccc(OCCCOCCCC)cc3O)nc(-c3ccc(OCCCOCCCC)cc3O)n2)c(O)c1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.51
▸ ALDH1A1 P00352 2/20 0.51
▸ MAPT P10636 2/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ GAA P10253 1/20 0.51
▸ RAB9A P51151 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ LTA4H P09960 2/20 0.46
▸ NR5A1 Q13285 1/20 0.46
▸ RARB P10826 1/20 0.43
▸ PTPN11 Q06124 2/20 0.41
▸ PLA2G4B P0C869 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ CNR2 P34972 2/20 0.40

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
SCHEMBL29502786 0.95 ALDH1A1 (0.50) NPC1ALDH1A1MAPTMEN1GAA
SCHEMBL14814843 0.95 ALDH1A1 (0.50) NPC1ALDH1A1MAPTMEN1GAA
SCHEMBL13021253 0.94 NPC1 (0.56) NPC1ALDH1A1MAPTMEN1GAA
SCHEMBL29364526 0.89 NR5A1 (0.60) NPC1ALDH1A1MAPTMEN1GAA
SCHEMBL999167 0.89 NR5A1 (0.60) NPC1ALDH1A1MAPTMEN1GAA
SCHEMBL7972017 0.89 NR5A1 (0.60) NPC1ALDH1A1MAPTMEN1GAA
SCHEMBL16258157 0.89 MAPT (0.60) NPC1ALDH1A1MAPTMEN1GAA
SCHEMBL29502758 0.89 NR5A1 (0.60) NPC1ALDH1A1MAPTMEN1GAA
SCHEMBL77484 0.89 NR5A1 (0.60) NPC1ALDH1A1MAPTMEN1GAA
SCHEMBL29502795 0.89 NR5A1 (0.60) NPC1ALDH1A1MAPTMEN1GAA

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
US-6916867-B2 Synergistic mixtures of UV-absorbers in polyolefins CIBA SPECIALTY CHEMICALS CORPORATION (US) 2005-07-12 — — US claimed
WO-2007127052-A2 BIREFRINGENT OPTICAL ELEMENTS HAVING REVERSE DISPERSION EASTMAN KODAK COMPANY (US) 2007-11-08 — — WO disclosed
US-20070247712-A1 Optical elements having reverse dispersion EASTMAN KODAK COMPANY 2007-10-25 — — US disclosed
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