SCHEMBL21914775

SCHEMBL21914775

C=CC(=O)Oc1ccc(C(=C)c2ccc(OC(=O)C=C)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.53
HSD17B10 Q99714 4/20 0.40
MAPT P10636 3/20 0.40
KMT2A Q03164 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
EGFR P00533 1/20 0.40
TP53 P04637 1/20 0.40
CYP3A4 P08684 1/20 0.40
PKM P14618 1/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
ALOX12 P18054 1/20 0.40
JAK1 P23458 1/20 0.40
MAPK1 P28482 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ELANE P08246 4/20 0.40
HTT P42858 1/20 0.39

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
SCHEMBL2587522 0.87 THRB (0.64) THRBHSD17B10MAPTKMT2ASMN1; SMN2
SCHEMBL25041907 0.85 THRB (0.55) THRBHSD17B10MAPTKMT2ASMN1; SMN2
SCHEMBL4132764 0.85 THRB (0.55) THRBMAPTKMT2AMEN1MAPK1
SCHEMBL11127955 0.84 THRB (0.54) THRBHSD17B10MAPTKMT2ASMN1; SMN2
SCHEMBL7455238 0.83 HSD17B10 (0.53) THRBHSD17B10MAPTKMT2ASMN1; SMN2
SCHEMBL18619583 0.83 ALDH5A1 (0.57) THRBHSD17B10MAPTKMT2ASMN1; SMN2
SCHEMBL1894950 0.83 HSD17B10 (0.53) THRBHSD17B10KMT2AALDH1A1KDM4E
SCHEMBL8836170 0.82 THRB (0.51) THRBHSD17B10MAPTKMT2ASMN1; SMN2
SCHEMBL2578957 0.82 THRB (0.51) THRBHSD17B10MAPTKMT2ASMN1; SMN2
SCHEMBL9763065 0.82 THRB (0.51) THRBHSD17B10MAPTKMT2ASMN1; SMN2

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
WO-2020059603-A1 IMPRINTING LAMINATED BODY, METHOD FOR MANUFACTURING IMPRINTING LAMINATED BODY, METHOD FOR FORMING PATTERN, AND KIT 富士フイルム株式会社 2020-03-26 WO disclosed