SCHEMBL16547098

SCHEMBL16547098

C=CC(=O)OCCCCCCCCCCCOc1ccc(OC(=O)C2CCC(C(=O)Oc3ccc(CCCCCC)cc3)CC2)cc1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 6/20 0.60
▸ THRA P10827 4/20 0.46
▸ S1PR5 Q9H228 8/20 0.45
▸ HPGD P15428 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ S1PR1 P21453 6/20 0.44
▸ S1PR3 Q99500 4/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ USP2 O75604 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ CASP1 P29466 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ SLCO1B3 Q9NPD5 1/20 0.44
▸ SLCO1B1 Q9Y6L6 1/20 0.44

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
SCHEMBL25485982 1.00 THRB (0.60) THRBTHRAS1PR5HPGDTSHR
SCHEMBL16547092 1.00 THRB (0.60) THRBTHRAS1PR5HPGDTSHR
SCHEMBL25485983 1.00 THRB (0.60) THRBTHRAS1PR5HPGDTSHR
SCHEMBL1073240 0.97 THRB (0.64) THRBTHRAS1PR5HPGDTSHR
SCHEMBL1071618 0.97 THRB (0.64) THRBTHRAS1PR5HPGDTSHR
SCHEMBL16996732 0.97 THRB (0.64) THRBTHRAS1PR5HPGDTSHR
SCHEMBL13089465 0.97 THRB (0.64) THRBTHRAS1PR5HPGDTSHR
SCHEMBL22451086 0.97 THRB (0.64) THRBTHRAS1PR5HPGDTSHR
SCHEMBL19958229 0.95 THRB (0.50) THRBTHRAS1PR5HPGDTSHR
SCHEMBL19844482 0.95 THRB (0.50) THRBTHRAS1PR5HPGDTSHR

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-20150062505-A1 OPTICALLY ANISOTROPIC SHEET SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-03-05 — — US disclosed
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