SCHEMBL5166180

SCHEMBL5166180

C=C(CCCCOCC)C(=O)O.C=C(CCCOCCC)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 9/20 0.40
THRB P10828 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
CES2 O00748 1/20 0.33
FNTA P49354 1/20 0.33
FNTB P49356 1/20 0.33
PGGT1B P53609 1/20 0.33
TSHR P16473 2/20 0.32
ALDH1A1 P00352 1/20 0.32
TBXAS1 P24557 1/20 0.32

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
SCHEMBL16196269 0.97 THRB (0.38) EPHX2THRBSMN1; SMN2CES2TSHR
SCHEMBL521500 0.93 EPHX2 (0.39) EPHX2THRBCES2FNTAFNTB
SCHEMBL521492 0.91 EPHX2 (0.41) EPHX2THRBCES2FNTAFNTB
SCHEMBL522916 0.91 EPHX2 (0.42) EPHX2THRBSMN1; SMN2CES2TSHR
SCHEMBL303832 0.91 TSHR (0.35) EPHX2THRBCES2FNTAFNTB
SCHEMBL33661 0.90 THRB (0.44) EPHX2THRBSMN1; SMN2TSHRALDH1A1
SCHEMBL16291822 0.90 EPHX2 (0.44) EPHX2THRBSMN1; SMN2CES2FNTA
SCHEMBL289015 0.90 THRB (0.44) EPHX2THRBSMN1; SMN2TSHRALDH1A1
SCHEMBL16291891 0.90 EPHX2 (0.44) EPHX2THRBSMN1; SMN2CES2FNTA
SCHEMBL215098 0.90 EPHX2 (0.44) EPHX2THRBSMN1; SMN2CES2FNTA

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-1476509-B1 SELF-POLISHING ANTIFOULING PAINT JOTUN AS (NO) 2007-04-11 EP claimed
EP-1476509-B1 SELF-POLISHING ANTIFOULING PAINT JOTUN AS (NO) 2007-04-11 EP disclosed