SCHEMBL17072943

SCHEMBL17072943

CC1(C)OB(c2ccc3c(c2)Oc2ccccc2C=C3)OC1(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ LPL P06858 13/20 0.46
▸ LIPG Q9Y5X9 13/20 0.46
▸ P4HB P07237 1/20 0.35
▸ PRMT5 O14744 1/20 0.35
▸ WDR77 Q9BQA1 1/20 0.35
▸ ROCK1 Q13464 1/20 0.34
▸ CA1 P00915 2/20 0.34
▸ CA2 P00918 2/20 0.34
▸ CA9 Q16790 2/20 0.34
▸ CA12 O43570 1/20 0.34
▸ CA3 P07451 1/20 0.34
▸ CA4 P22748 1/20 0.34
▸ CA6 P23280 1/20 0.34
▸ CA5A P35218 1/20 0.34
▸ CA7 P43166 1/20 0.34

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
SCHEMBL17072840 0.92 LPL (0.47) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL47074 0.82 LPL (0.53) LPLLIPGP4HBROCK1CA1
SCHEMBL20845220 0.81 LPL (0.40) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL23504623 0.77 LPL (0.47) KDM4ELPLLIPGP4HBPRMT5
SCHEMBL21764405 0.77 LPL (0.47) KDM4ELPLLIPGP4HBPRMT5
SCHEMBL10074115 0.77 LPL (0.48) LPLLIPGP4HBCA1CA2
SCHEMBL10074112 0.77 LPL (0.48) LPLLIPGP4HBCA1CA2
SCHEMBL17072973 0.76 GAA (0.48) MAPTLPLLIPGP4HBPRMT5
SCHEMBL18333498 0.76 ALOX5 (0.52) LPLLIPGPRMT5WDR77
SCHEMBL17072854 0.76 MEN1 (0.38) KDM4EMEN1ALDH1A1MAPTKMT2A

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-2015133807-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME 주식회사 두산 2015-09-11 — — WO disclosed
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