SCHEMBL6554747

SCHEMBL6554747

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

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.37
KDM1A O60341 1/20 0.34
HIF1A Q16665 2/20 0.33
EPAS1 Q99814 2/20 0.33
OGA O60502 1/20 0.33
MAPT P10636 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
TTR P02766 1/20 0.32
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TAS1R3 Q7RTX0 4/20 0.31
TAS1R1 Q7RTX1 4/20 0.31
PPARG P37231 1/20 0.31
PPARA Q07869 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31

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
SCHEMBL6554326 0.88 ACACB (0.34) MAPTTAS1R3TAS1R1HDAC8HDAC6
SCHEMBL6550872 0.85 STAT3 (0.42) MAPTMEN1KMT2ATAS1R3TAS1R1
SCHEMBL3837576 0.84 STAT3 (0.37) HIF1AEPAS1TTRAPPBCHE
SCHEMBL6843705 0.83 ELANE (0.38) ELANEKDM1AHIF1AEPAS1APP
SCHEMBL2474025 0.82 ELANE (0.44) ELANEKDM1AHIF1AEPAS1OGA
SCHEMBL4967554 0.79 BCHE (0.34) HIF1AEPAS1MAPTKDM4EMEN1
SCHEMBL7617965 0.79 TAS1R3 (0.39) HIF1AMAPTCYP3A4TAS1R3TAS1R1
SCHEMBL6278463 0.79 BCHE (0.34) HIF1AEPAS1MAPTKDM4EMEN1
SCHEMBL8587205 0.78 CHRNB2 (0.33) HIF1AEPAS1TAS1R3TAS1R1PPARG
4-Vinylphenol SCHEMBL7702861 0.78 ELANE (0.41) ELANEKDM1AHIF1AEPAS1OGA

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 2 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
EP-1059314-A1 A resist composition Wako Pure Chemical Industries, Ltd. (JP) 2000-12-13 EP disclosed