SCHEMBL6554393

SCHEMBL6554393

C=CC(=O)OC1CCCCC1.CCOC(C)Oc1ccc(C=CC=Cc2ccc(OC(=O)OC(C)(C)C)cc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 3/20 0.33
ELANE P08246 1/20 0.33
CACNA1B Q00975 1/20 0.32
PPARG P37231 1/20 0.32
PPARD Q03181 1/20 0.32
PPARA Q07869 1/20 0.32
HTT P42858 1/20 0.32
KDM1A O60341 1/20 0.31
HIF1A Q16665 1/20 0.30
EPAS1 Q99814 1/20 0.30

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
SCHEMBL2127874 0.87 CA12 (0.36) PPARGPPARDPPARAHTT
SCHEMBL6843705 0.80 ELANE (0.38) ELANEKDM1AHIF1AEPAS1
4-Vinylphenol SCHEMBL5702426 0.79 PPARG (0.34) PPARGPPARDPPARAHTT
SCHEMBL7270935 0.79 STAT3 (0.34) HTT
SCHEMBL7101076 0.78 CA12 (0.39) HIF1AEPAS1
SCHEMBL6554747 0.78 ELANE (0.37) ELANEPPARGPPARAKDM1AHIF1A
SCHEMBL7265047 0.77 CA12 (0.35) PPARGPPARDPPARAHTT
SCHEMBL7269876 0.76 STAT3 (0.37) HTT
SCHEMBL3839026 0.76 STAT3 (0.35) NR1H4CACNA1BHTT
SCHEMBL8098055 0.75 CYP2C19 (0.41) ELANE

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1059314-B1 A resist composition WAKO PURE CHEM IND LTD (JP) 2004-12-22 EP disclosed
US-6716573-B2 Resist Composition WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2004-04-06 US disclosed
US-20030039920-A1 Resist composition WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2003-02-27 US disclosed
US-6432608-B1 FINENESS PATTERN WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2002-08-13 US disclosed
EP-1059314-A1 A resist composition Wako Pure Chemical Industries, Ltd. (JP) 2000-12-13 EP disclosed