SCHEMBL12808652

SCHEMBL12808652

N#Cc1c(Cc2cccc(N)c2)cccc1Oc1cccc(N)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.41
AS3MT Q9HBK9 1/20 0.39
POLB P06746 1/20 0.37
HSP90AA1 P07900 1/20 0.37
MAPT P10636 1/20 0.37
CYP3A4 P08684 2/20 0.36
TP53 P04637 1/20 0.36
MEN1 O00255 1/20 0.35
CNR1 P21554 1/20 0.35
GPR183 P32249 1/20 0.35
CNR2 P34972 1/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CARM1 Q86X55 1/20 0.35
MAOA P21397 2/20 0.34
APP P05067 1/20 0.34
FNTA P49354 1/20 0.34
FNTB P49356 1/20 0.34
PGGT1B P53609 1/20 0.34
MPO P05164 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
SCHEMBL28030201 0.83 MAOB (0.44) MAOBAS3MTCYP3A4MEN1KMT2A
SCHEMBL29492474 0.83 MAOB (0.53) MAOBAS3MTPOLBHSP90AA1MAPT
SCHEMBL201559 0.83 MAOB (0.53) MAOBAS3MTPOLBHSP90AA1MAPT
SCHEMBL3131523 0.81 MAOB (0.52) MAOBAS3MTPOLBHSP90AA1MAPT
SCHEMBL17085525 0.81 MAOB (0.52) MAOBAS3MTPOLBHSP90AA1MAPT
SCHEMBL13712609 0.80 MAOB (0.47) MAOBPOLBHSP90AA1MAPTCYP3A4
SCHEMBL31183019 0.77 MAOB (0.47) MAOBPOLBHSP90AA1MAPTCYP3A4
SCHEMBL28096016 0.77 MAOB (0.47) MAOBPOLBHSP90AA1MAPTCYP3A4
SCHEMBL29617521 0.77 MAOB (0.47) MAOBPOLBHSP90AA1MAPTCYP3A4
SCHEMBL17085526 0.76 ALDH1A1 (0.51) MAOBAS3MTPOLBHSP90AA1MAPT

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-7906043-B2 Electrically conductive, optically transparent polymer/carbon nanotube composites and process for preparation thereof THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 2011-03-15 US disclosed
US-20100078600-A1 Electrically Conductive, Optically Transparent Polymer/Carbon Nanotube Composites And Process For Preparation Thereof USA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 2010-04-01 US disclosed