SCHEMBL13285166

SCHEMBL13285166

CC1(C)c2cc(C(=O)c3cccc4ccccc34)ccc2-c2cc3c(cc21)c1ccc(C(=O)c2cccc4ccccc24)cc1n3-c1cccc2ccccc12

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 1/20 0.37
▸ BCL2 P10415 1/20 0.36
▸ MCL1 Q07820 1/20 0.36
▸ BAD Q92934 1/20 0.36
▸ CDC25B P30305 1/20 0.36
▸ CNR2 P34972 8/20 0.35
▸ GCGR P47871 2/20 0.35
▸ HTR6 P50406 2/20 0.35
▸ CNR1 P21554 2/20 0.34
▸ BCHE P06276 1/20 0.34
▸ H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 P62805 1/20 0.34
▸ EP300 Q09472 1/20 0.34
▸ PRMT1 Q99873 1/20 0.34
▸ FNTA P49354 1/20 0.33
▸ FNTB P49356 1/20 0.33
▸ CBX7 O95931 1/20 0.33
▸ CDY1; CDY1B Q9Y6F8 1/20 0.33

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
SCHEMBL12116393 0.90 BCL2 (0.39) BCL2MCL1BADCDC25BCNR2
SCHEMBL14073397 0.83 CNR2 (0.45) BCL2MCL1BADCDC25BCNR2
SCHEMBL2603516 0.82 CNR2 (0.38) BCL2MCL1BADCNR2
SCHEMBL17228839 0.78 MEN1 (0.40) CNR2CNR1
SCHEMBL12116386 0.77 PDK2 (0.43) CNR2
SCHEMBL17988933 0.77 MEN1 (0.36) CNR2CNR1FNTAFNTB
SCHEMBL17988915 0.76 MEN1 (0.38) CNR2CNR1
SCHEMBL17245829 0.75 MAPT (0.40) HTR6
SCHEMBL2603514 0.74 PDK2 (0.38) CNR2
SCHEMBL12116382 0.74 CNR2 (0.43) CNR2

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-2010083873-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2010-07-29 — — WO disclosed
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