SCHEMBL3418963

SCHEMBL3418963

B.CC(C)(C)OC(=O)c1ccccc1O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.60
TSHR P16473 2/20 0.60
HPGD P15428 7/20 0.52
HSD17B10 Q99714 4/20 0.52
ALOX15 P16050 2/20 0.52
TDP1 Q9NUW8 2/20 0.50
ALDH1A1 P00352 6/20 0.47
KDM4E B2RXH2 5/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
HMGB1 P09429 1/20 0.47
CA4 P22748 1/20 0.47
CA6 P23280 1/20 0.47
CA7 P43166 1/20 0.47
CA9 Q16790 1/20 0.47
NAPRT Q6XQN6 1/20 0.47
CA14 Q9ULX7 1/20 0.47
ADRB2 P07550 1/20 0.47

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
SCHEMBL29701290 0.98 LMNA (0.62) LMNATSHRHPGDHSD17B10ALOX15
SCHEMBL39310 0.98 LMNA (0.62) LMNATSHRHPGDHSD17B10ALOX15
SCHEMBL14236815 0.96 LMNA (0.60) LMNATSHRHPGDHSD17B10ALOX15
SCHEMBL5033583 0.96 LMNA (0.60) LMNATSHRHPGDHSD17B10ALOX15
Bromide SCHEMBL6849788 0.96 LMNA (0.60) LMNATSHRHPGDHSD17B10ALOX15
SCHEMBL1782675 0.96 LMNA (0.60) LMNATSHRHPGDHSD17B10ALOX15
SCHEMBL10353738 0.96 LMNA (0.60) LMNATSHRHPGDHSD17B10ALOX15
SCHEMBL31134837 0.96 LMNA (0.60) LMNATSHRHPGDHSD17B10ALOX15
SCHEMBL28737706 0.96 LMNA (0.60) LMNATSHRHPGDHSD17B10ALOX15
Lithium SCHEMBL14236817 0.96 LMNA (0.60) LMNATSHRHPGDHSD17B10ALOX15

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-2010004833-A1 METAL COMPLEX DYE AND DISPLAY FILTER 山田化学工業株式会社 (JP) 2010-01-14 WO disclosed