SCHEMBL16159339

SCHEMBL16159339

c1ccc(-n2c3cc(-c4cccc(-c5cscn5)c4)ccc3c3c4ccccc4c(-c4cccc(-c5cscn5)c4)cc32)cc1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.42
KAT6A Q92794 1/20 0.34
RORC P51449 1/20 0.34
GRK5 P34947 1/20 0.31
PIK3R2 O00459 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ATM Q13315 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL16159674 0.91 SCN9A (0.32) SCN9ARORCPIK3R2SMN1; SMN2KDM4E
SCHEMBL16159350 0.88 SCN9A (0.43) SCN9AKAT6ARORCGRK5SMN1; SMN2
SCHEMBL9887013 0.84 HTR1A (0.39)
SCHEMBL9887474 0.82 MEN1 (0.41) KDM4EATML3MBTL1
SCHEMBL16159345 0.81 SCN9A (0.45) SCN9AKDM4EATML3MBTL1
SCHEMBL16159515 0.80 KDM4E (0.39) SCN9AKAT6ARORCGRK5SMN1; SMN2
SCHEMBL16159082 0.80 KDR (0.36) RORCSMN1; SMN2KDM4EATML3MBTL1
SCHEMBL16159290 0.79 PDPK1 (0.42) KAT6ARORCPIK3R2KDM4E
SCHEMBL17116509 0.78 PIK3R2 (0.37) PIK3R2
SCHEMBL9887459 0.78 CYP11B1 (0.40) L3MBTL1

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 1106/4885RORC 1829/4885

“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.