SCHEMBL15434189

SCHEMBL15434189

CC1(C)c2ccccc2-c2ccc3c(c21)C(c1ccccc1)(c1ccccc1)c1c-3ccc2sc3ccccc3c12

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
DUSP3 P51452 1/20 0.33
BLM P54132 1/20 0.33
PTPN5 P54829 1/20 0.33
KMT2A Q03164 1/20 0.33
PTPN11 Q06124 1/20 0.33
MCL1 Q07820 1/20 0.33
CTDSP1 Q9GZU7 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
GPR3 P46089 1/20 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
SCHEMBL15434193 0.91 MAPT (0.35) MEN1POLBMAPTDUSP3BLM
SCHEMBL24557138 0.87 MAPT (0.38) MEN1POLBMAPTDUSP3BLM
SCHEMBL19108392 0.83 MAPT (0.36) MEN1POLBMAPTDUSP3BLM
SCHEMBL15434194 0.83 PARP14 (0.36) GPR3
SCHEMBL19760321 0.81 GPR3 (0.41) MEN1POLBMAPTDUSP3BLM
SCHEMBL15434196 0.81 MAPT (0.35) MEN1POLBMAPTDUSP3KMT2A
SCHEMBL22930686 0.79 MAPT (0.38) MEN1POLBMAPTDUSP3BLM
SCHEMBL23185154 0.78 MAPT (0.36) MEN1POLBMAPTDUSP3BLM
SCHEMBL22182191 0.77 MAPT (0.35) MEN1POLBMAPTDUSP3BLM
SCHEMBL20127176 0.77 MEN1 (0.34) MEN1POLBMAPTDUSP3BLM

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-2014010910-A1 COMPOUND, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산하이메탈(주) (KR) 2014-01-16 WO disclosed