SCHEMBL14415083

SCHEMBL14415083

CCCCCCCCCCCCS/C=C/C(=O)Oc1cc2c3cc(OC(=O)/C=C/SCCCCCCCCCCCC)c(OC(=O)/C=C/SCCCCCCCCCCCC)cc3c3cc(OC(=O)/C=C/SCCCCCCCCCCCC)c(OC(=O)/C=C/SCCCCCCCCCCCC)cc3c2cc1OC(=O)/C=C/SCCCCCCCCCCCC

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 3/20 0.38
▸ THRA P10827 1/20 0.37
▸ THRB P10828 1/20 0.37
▸ ASAH1 Q13510 2/20 0.36
▸ ZDHHC2 Q9UIJ5 1/20 0.36
▸ DEGS1 O15121 1/20 0.36
▸ ALOX5 P09917 1/20 0.36
▸ LMNA P02545 2/20 0.34
▸ NPSR1 Q6W5P4 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ NSD2 O96028 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ APP P05067 3/20 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
SCHEMBL14415078 1.00 PTGS2 (0.38) PTGS2THRATHRBASAH1ZDHHC2
SCHEMBL14282664 0.78 HTR1A (0.45) ALOX5LMNATDP1
SCHEMBL14415098 0.77 ASAH1 (0.46) THRBASAH1DEGS1ALOX5MAPT
SCHEMBL4295915 0.77 ASAH1 (0.46) THRBASAH1DEGS1ALOX5MAPT
SCHEMBL10491115 0.77 ASAH1 (0.46) THRBASAH1DEGS1ALOX5MAPT
SCHEMBL11763024 0.77 ASAH1 (0.46) THRBASAH1DEGS1ALOX5MAPT
SCHEMBL4295919 0.77 ASAH1 (0.46) THRBASAH1DEGS1ALOX5MAPT
SCHEMBL14415096 0.77 ASAH1 (0.46) THRBASAH1DEGS1ALOX5MAPT
SCHEMBL10491113 0.77 ASAH1 (0.46) THRBASAH1DEGS1ALOX5MAPT
SCHEMBL14282662 0.76 LTA4H (0.45) ALOX5LMNAMAPTMEN1KMT2A

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-7273641-B2 Optically anisotropic element comprising discotic compound FUJIFILM CORPORATION (JP) 2007-09-25 — — US disclosed
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