SCHEMBL13752254

SCHEMBL13752254

C=C1C(C)=C(O)C(=O)c2c1ccc(O)c2O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 8/20 0.50
▸ MAPT P10636 8/20 0.50
▸ KMT2A Q03164 8/20 0.50
▸ KDM4E B2RXH2 6/20 0.50
▸ ALDH1A1 P00352 5/20 0.50
▸ RECQL P46063 5/20 0.50
▸ HPGD P15428 4/20 0.50
▸ MAOA P21397 4/20 0.50
▸ MAPK1 P28482 4/20 0.50
▸ CYP3A4 P08684 3/20 0.50
▸ ALOX15 P16050 3/20 0.50
▸ HSD17B10 Q99714 3/20 0.50
▸ USP2 O75604 3/20 0.50
▸ APEX1 P27695 2/20 0.50
▸ THRB P10828 2/20 0.50
▸ BRCA1 P38398 2/20 0.50
▸ TDP1 Q9NUW8 2/20 0.50
▸ RAF1 P04049 1/20 0.50
▸ TP53 P04637 1/20 0.50
▸ CSNK2A2 P19784 1/20 0.50

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
Dioncoquinone B SCHEMBL3401149 0.84 MEN1 (0.60) MEN1MAPTKMT2AKDM4EALDH1A1
SCHEMBL7154751 0.75 MAPT (0.69) MEN1MAPTKMT2AKDM4EALDH1A1
SCHEMBL16088854 0.74 MAPT (0.73) MEN1MAPTKMT2AKDM4EALDH1A1
SCHEMBL2772226 0.72 MAPT (0.86) MEN1MAPTKMT2AKDM4EALDH1A1
SCHEMBL6904748 0.71 MAPT (0.83) MEN1MAPTKMT2AKDM4EALDH1A1
SCHEMBL29359549 0.71 ELANE (0.70) MEN1MAPTKMT2AKDM4EALDH1A1
SCHEMBL10909836 0.71 ELANE (0.70) MEN1MAPTKMT2AKDM4EALDH1A1
SCHEMBL30432375 0.71 ELANE (0.70) MEN1MAPTKMT2AKDM4EALDH1A1
SCHEMBL14213384 0.70 MEN1 (0.61) MEN1MAPTKMT2AKDM4EALDH1A1
SCHEMBL12846567 0.69 MAPT (0.41) MEN1MAPTKMT2AKDM4EALDH1A1

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
EP-2093207-A1 Antiinfective and antitumoral compounds isolated from tropical lianas Julius-Maximilians-Universität Würzburg (DE) 2009-08-26 — — EP disclosed
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