SCHEMBL17072854

SCHEMBL17072854

CC1(C)OB(c2cccc3c2C=Cc2ccccc2O3)OC1(C)C

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ POLB P06746 1/20 0.36
▸ CASP6 P55212 1/20 0.36
▸ LPL P06858 3/20 0.36
▸ LIPG Q9Y5X9 3/20 0.36
▸ TRPA1 O75762 1/20 0.31
▸ JAK2 O60674 2/20 0.31
▸ BTK Q06187 2/20 0.31

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
SCHEMBL17072806 0.85 LPL (0.36) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL17072956 0.78 GAA (0.47) MAPTLPLLIPGJAK2BTK
SCHEMBL17072840 0.77 LPL (0.47) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL21410590 0.77 LPL (0.34) LPLLIPG
SCHEMBL17072943 0.76 KDM4E (0.49) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL17485149 0.75 KDM4E (0.40) KDM4ELPLLIPGJAK2BTK
SCHEMBL18563346 0.74 AHR (0.43) LPLLIPGJAK2BTK
SCHEMBL17029070 0.72 LPL (0.34) MAPTLPLLIPGJAK2BTK
SCHEMBL5899734 0.72 LPL (0.54) LPLLIPG
SCHEMBL21764400 0.71 LPL (0.37) KDM4ELPLLIPG

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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