SCHEMBL28831017

SCHEMBL28831017

O=C1Cc2ccccc2-c2cccc(-c3ccc(O)cc3)c21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.46
CES1 P23141 1/20 0.46
MIF P14174 2/20 0.44
TDP2 O95551 3/20 0.43
ABL1 P00519 1/20 0.41
ABCB1 P08183 1/20 0.41
BCR P11274 1/20 0.41
CHEK1 O14757 1/20 0.40
ALDH1A1 P00352 2/20 0.40
LMNA P02545 1/20 0.40
MAOA P21397 1/20 0.40
KDM4E B2RXH2 1/20 0.39
HPGD P15428 1/20 0.39
BACE1 P56817 2/20 0.38
PTPN1 P18031 1/20 0.38
HSD17B1 P14061 1/20 0.38
ESR2 Q92731 1/20 0.38
TYR P14679 1/20 0.38
HDAC4 P56524 1/20 0.37
HDAC2 Q92769 1/20 0.37

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
SCHEMBL9395404 0.81 MAOA (0.53) BCHECES1MIFTDP2ABL1
SCHEMBL30944682 0.81 MAOA (0.53) BCHECES1MIFTDP2ABL1
SCHEMBL28310603 0.77 ALDH1A1 (0.50) TDP2ALDH1A1LMNAKDM4EHPGD
SCHEMBL29662156 0.77 ALDH1A1 (0.50) TDP2ALDH1A1LMNAKDM4EHPGD
Fluorene SCHEMBL445897 0.77 MMP3 (0.54) MIFTDP2ABL1ABCB1BCR
SCHEMBL441982 0.76 PNMT (0.51) MIFABL1ABCB1BCRCHEK1
SCHEMBL27796980 0.76 MAOA (0.40) BCHECES1MIFLMNAMAOA
SCHEMBL1828388 0.75 CHEK1 (0.48) MIFABL1ABCB1BCRCHEK1
SCHEMBL29907851 0.75 CHEK1 (0.48) MIFABL1ABCB1BCRCHEK1
SCHEMBL27770268 0.74 MAOA (0.53) BCHECES1MIFABL1ABCB1

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
CN-103842434-B Composition epoxy resin and use the radiant heat circuit board of this composition epoxy resin LG伊诺特有限公司 2016-07-13 CN disclosed