SCHEMBL10114727

SCHEMBL10114727

Cc1ccc2[nH]c3ccc(C(c4ccc(N(c5ccc(C(C)c6cccc7ccccc67)cc5)c5ccc(C(C)c6cccc7ccccc67)cc5)cc4)c4cccc5ccccc45)cc3c2c1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
POLB P06746 1/20 0.36
KMT2A Q03164 1/20 0.36
ADRA2A P08913 4/20 0.34
ADRA2B P18089 4/20 0.34
ADRA2C P18825 4/20 0.34
KIF11 P52732 3/20 0.34
ADRA1A P35348 2/20 0.33
ADRA1D P25100 1/20 0.33
ADRA1B P35368 1/20 0.33
CASR P41180 2/20 0.33
MLKL Q8NB16 1/20 0.33
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ACHE P22303 1/20 0.32

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
SCHEMBL10114728 0.98 MEN1 (0.35) MEN1NPC1POLBKMT2AADRA2A
SCHEMBL10114699 0.85 MEN1 (0.46) MEN1NPC1POLBKMT2AADRA2A
SCHEMBL10114729 0.82 MLKL (0.46) MEN1NPC1POLBKMT2AKIF11
SCHEMBL10114753 0.81 MLKL (0.45) MEN1NPC1POLBKMT2AKIF11
SCHEMBL12888135 0.76 SIGMAR1 (0.35) MAPT
SCHEMBL14564931 0.73 NPC1 (0.48) MEN1NPC1POLBKMT2AKIF11
SCHEMBL3142829 0.73 KIF11 (0.49) MEN1NPC1POLBKMT2AKIF11
SCHEMBL14564928 0.73 NPC1 (0.44) MEN1NPC1POLBKMT2AKIF11
SCHEMBL13721563 0.71 SIGMAR1 (0.38) MAPT
SCHEMBL10114714 0.71 NPC1 (0.48) MEN1NPC1POLBKMT2AKIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8722841-B2 Carbazole novolak resin NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2014-05-13 US disclosed
US-8674052-B2 Carbazole novolak resin NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2014-03-18 US disclosed
US-20130122710-A1 CARBAZOLE NOVOLAK RESIN NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2013-05-16 US disclosed
US-20120077345-A1 CARBAZOLE NOVOLAK RESIN NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2012-03-29 US disclosed