SCHEMBL16265121

SCHEMBL16265121

BB(B)B(B(B)B)B(B(B(B)B)B(B)B)C1CCC(C2CCC(c3ccc(Oc4cc(N)cc(N)c4)cc3)CC2)CC1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 2/20 0.34
SCN9A Q15858 2/20 0.34
KCNH2 Q12809 1/20 0.34
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
NLRP3 Q96P20 1/20 0.33
F2 P00734 1/20 0.31
PRSS1 P07477 1/20 0.31
PRSS2 P07478 1/20 0.31
PRSS3 P35030 1/20 0.31
ST14 Q9Y5Y6 1/20 0.31

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
SCHEMBL16265122 0.93 SCN5A (0.34) SCN5ASCN9AKCNH2MEN1NPC1
SCHEMBL16265148 0.84 KDM4E (0.32) MEN1KMT2A
SCHEMBL16265127 0.82 MRGPRX4 (0.31) KMT2AF2PRSS1PRSS2PRSS3
SCHEMBL17722784 0.80 SCN5A (0.39) SCN5ASCN9AKCNH2MEN1NPC1
SCHEMBL12220494 0.78 ESR2 (0.44) SCN5ASCN9AKCNH2MEN1NPC1
SCHEMBL12241902 0.77 SLC6A2 (0.36) SCN5ASCN9AKCNH2MEN1NPC1
SCHEMBL16265129 0.77 SLC6A2 (0.32)
SCHEMBL16577059 0.75
SCHEMBL16265109 0.75 NPC1 (0.32) NPC1RAB9AKMT2AF2PRSS1
SCHEMBL16265147 0.75 LMNA (0.36) KMT2A

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-20150274969-A1 LIQUID CRYSTAL ALIGNMENT AGENT AND USES THEREOF CHI MEI CORPORATION (TW) 2015-10-01 US disclosed
US-20140350179-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY ELEMENT HAVING THEREOF CHI MEI CORPORATION (TW) 2014-11-27 US disclosed