SCHEMBL3881815

SCHEMBL3881815

C=CCc1cc2cc(C(=O)Nc3ccc(CN(C)C)cc3)c(=O)oc2cc1OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.50
POLB P06746 2/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
PLEC Q15149 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
LMNA P02545 1/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
TP53 P04637 1/20 0.47
MAOB P27338 10/20 0.47
MAOA P21397 3/20 0.47
F12 P00748 1/20 0.44
KDM4E B2RXH2 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA4 P22748 1/20 0.44
CA5A P35218 1/20 0.44
CA7 P43166 1/20 0.44

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
SCHEMBL4523523 0.83 MAPT (0.53) MAPTPOLBMEN1KMT2APLEC
SCHEMBL3880564 0.80 MAPT (0.77) MAPTPOLBMEN1KMT2APLEC
SCHEMBL4531436 0.77 MAPT (0.55) MAPTPOLBMEN1KMT2APLEC
SCHEMBL28641067 0.77 MAPT (0.76) MAPTPOLBMEN1KMT2ANPC1
SCHEMBL3878896 0.76 MAPT (0.54) MAPTPOLBMEN1KMT2APLEC
SCHEMBL3955610 0.75 TP53 (0.55) MAPTTP53MAOBMAOA
SCHEMBL4520996 0.75 TP53 (0.56) MAPTTP53MAOBMAOA
SCHEMBL3952993 0.74 TP53 (0.55) MAPTTP53MAOBMAOAKDM4E
SCHEMBL4528661 0.73 MAPT (0.42) MAPTPOLBMEN1KMT2APLEC
SCHEMBL3880339 0.73 S1PR1 (0.63) MAPTPOLBLMNATP53MAOB

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
EP-2010511-A1 CHROMEN-2-ONE DERIVATIVES Novartis AG (CH) 2009-01-07 EP claimed
WO-2007115820-A1 CHROMEN-2-ONE DERIVATIVES NOVARTIS AG (CH) 2007-10-18 WO claimed