SCHEMBL16159355

SCHEMBL16159355

c1ccc(-c2ccccc2-c2ccc3c(-c4cc(-c5cscn5)ccn4)c4ccccc4c(-c4cc(-c5cscn5)ccn4)c3c2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.44
KAT6A Q92794 1/20 0.38
KDM4A O75164 2/20 0.36
KDM4B O94953 2/20 0.36
KDM5C P41229 2/20 0.36
KDM5B Q9UGL1 2/20 0.36
PIK3CA P42336 1/20 0.36
TGFBR1 P36897 1/20 0.33
CHEK2 O96017 1/20 0.33
PRKDC P78527 2/20 0.33
IMPDH2 P12268 1/20 0.33
GRM5 P41594 1/20 0.31
IDO1 P14902 2/20 0.31
ESR1 P03372 1/20 0.31
ACVR1 Q04771 2/20 0.31
IKBKB O14920 1/20 0.31
CHUK O15111 1/20 0.31
DAPK3 O43293 1/20 0.31
JAK2 O60674 1/20 0.31
PRKD3 O94806 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
SCHEMBL16159761 0.91 KAT6A (0.40) SCN9AKAT6AKDM4AKDM4BKDM5C
SCHEMBL16159352 0.91 KAT6A (0.40) SCN9AKAT6AKDM4AKDM4BKDM5C
SCHEMBL16159478 0.90 KDM4A (0.42) SCN9AKAT6AKDM4AKDM4BKDM5C
SCHEMBL16159800 0.89 SCN9A (0.42) SCN9AKAT6AKDM4AKDM4BKDM5C
SCHEMBL16159784 0.89 SCN9A (0.39) SCN9AKAT6AKDM4AKDM4BKDM5C
SCHEMBL16159347 0.88 SCN9A (0.42) SCN9AKAT6AKDM4AKDM4BKDM5C
SCHEMBL16159669 0.87 SCN9A (0.44) SCN9AKAT6AKDM4AKDM4BKDM5C
SCHEMBL16159097 0.86 SCN9A (0.42) SCN9AKAT6AKDM4AKDM4BKDM5C
SCHEMBL16159767 0.86 SCN9A (0.38) SCN9AKAT6APIK3CATGFBR1IDO1
SCHEMBL16159346 0.85 KDM4A (0.43) SCN9AKAT6AKDM4AKDM4BKDM5C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160118598-A1 ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME JNC CORPORATION (JP) 2016-04-28 US disclosed
US-20160118598-A1 ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME JNC CORPORATION (JP) 2016-04-28 US disclosed
WO-2014163173-A1 ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME JNC株式会社 (JP) 2014-10-09 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160118598-A1 ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME HVCN1, VDAC1, SLC26A3 SCN9A 1007/4885KAT6A 1106/4885KDM4A 601/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.