SCHEMBL12435103

SCHEMBL12435103

COC(=O)c1ccccc1Nc1ccc2c(c1)C(C)(C)c1ccccc1N2c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.51
▸ ALOX15 P16050 1/20 0.51
▸ PGR P06401 1/20 0.41
▸ SIRT2 Q8IXJ6 1/20 0.40
▸ KDM4E B2RXH2 5/20 0.39
▸ POLB P06746 1/20 0.39
▸ ATM Q13315 1/20 0.39
▸ MYC P01106 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ GAA P10253 2/20 0.38
▸ LMNA P02545 1/20 0.38
▸ CTSV O60911 1/20 0.38
▸ CTSL P07711 1/20 0.38
▸ ALDH1A1 P00352 3/20 0.37
▸ HPGD P15428 2/20 0.37
▸ MAPK10 P53779 1/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ GLA P06280 1/20 0.36
▸ PTGS2 P35354 2/20 0.36
▸ PTGS1 P23219 1/20 0.36

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
SCHEMBL31918 0.80 PGR (0.42) MAPTPGRLMNAALDH1A1MAPK10
SCHEMBL12109355 0.79 MAPT (0.60) MAPTALOX15SIRT2KDM4EPOLB
SCHEMBL29945219 0.79 PGR (0.53) MAPTALOX15PGRTSHRGAA
SCHEMBL18290497 0.79 ALOX15 (0.44) MAPTALOX15SIRT2KDM4EPOLB
SCHEMBL16892742 0.78 MAPT (0.56) MAPTALOX15SIRT2KDM4EPOLB
SCHEMBL12435097 0.78 PGR (0.40) MAPTPGRLMNAALDH1A1KMT2A
SCHEMBL12109299 0.77 MAPT (0.57) MAPTALOX15SIRT2KDM4EPOLB
SCHEMBL19717457 0.75 MYC (0.54) MAPTALOX15KDM4EPOLBATM
SCHEMBL23637326 0.75 PGR (0.46) PGRALDH1A1KMT2AMEN1
SCHEMBL13828515 0.74 MAPT (0.53) MAPTALOX15SIRT2KDM4EPOLB

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-2011093609-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2011-08-04 — — WO disclosed
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