SCHEMBL12259684

SCHEMBL12259684

COc1ccc(C2(c3cccc(OC)c3)C=Cc3c(cc(N4CCOCC4)c4ccccc34)O2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 5/20 0.39
POLB P06746 1/20 0.39
ALDH1A1 P00352 8/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
KDM4E B2RXH2 4/20 0.37
CYP2C19 P33261 4/20 0.37
MAPT P10636 3/20 0.37
CYP3A4 P08684 3/20 0.37
CYP2C9 P11712 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
LMNA P02545 2/20 0.37
THRB P10828 1/20 0.37
BLM P54132 1/20 0.37
MAPK1 P28482 2/20 0.35
HPGD P15428 2/20 0.35
CYP1A2 P05177 2/20 0.35
KMT2A Q03164 3/20 0.35
HSD17B10 Q99714 2/20 0.35
MEN1 O00255 2/20 0.35
TSHR P16473 2/20 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
SCHEMBL2417015 0.94 PRKDC (0.40) PRKDCPOLBALDH1A1SMN1; SMN2KDM4E
SCHEMBL29375169 0.94 PRKDC (0.41) PRKDCPOLBALDH1A1SMN1; SMN2KDM4E
SCHEMBL2456236 0.94 PRKDC (0.41) PRKDCPOLBALDH1A1SMN1; SMN2KDM4E
SCHEMBL12205748 0.91 PRKDC (0.39) PRKDCPOLBALDH1A1SMN1; SMN2KDM4E
SCHEMBL14607589 0.90 POLB (0.40) PRKDCPOLBALDH1A1SMN1; SMN2KDM4E
SCHEMBL7471010 0.88 NPSR1 (0.37) PRKDCPOLBALDH1A1SMN1; SMN2KDM4E
SCHEMBL8845387 0.87 LMNA (0.38) PRKDCPOLBALDH1A1SMN1; SMN2KDM4E
SCHEMBL5707975 0.87 MAPT (0.38) PRKDCPOLBALDH1A1SMN1; SMN2KDM4E
SCHEMBL8845473 0.87 MAPT (0.40) PRKDCPOLBALDH1A1SMN1; SMN2KDM4E
SCHEMBL9089714 0.87 SIGMAR1 (0.37) PRKDCPOLBALDH1A1SMN1; SMN2KDM4E

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8012588-B2 Layered product, optical part, processes for producing these, and coating fluid TOKUYAMA CORPORATION (JP) 2011-09-06 US disclosed
US-8012588-B2 Layered product, optical part, processes for producing these, and coating fluid TOKUYAMA CORPORATION (JP) 2011-09-06 US disclosed