SCHEMBL16159201

SCHEMBL16159201

c1ccc(-c2cc3c4cc(-c5ccc(-c6cocn6)cc5)ccc4c4ccc(-c5ccc(-c6cocn6)cc5)cc4c3cc2-c2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 2/20 0.45
HDAC4 P56524 1/20 0.40
IMPDH2 P12268 3/20 0.40
PIK3CA P42336 1/20 0.38
EDNRB P24530 1/20 0.37
EDNRA P25101 1/20 0.37
PLAU P00749 2/20 0.35
MAP4K4 O95819 1/20 0.35
CDK8 P49336 2/20 0.34
AXL P30530 1/20 0.34
TNIK Q9UKE5 1/20 0.34
PLG P00747 1/20 0.33
GSK3B P49841 1/20 0.33
TOP1 P11387 1/20 0.33
TRIM58 Q8NG06 1/20 0.33
JAK2 O60674 2/20 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
SCHEMBL16159135 0.89 SCN9A (0.43) SCN9AHDAC4IMPDH2PIK3CAEDNRB
SCHEMBL16159397 0.88 SCN9A (0.54) SCN9AHDAC4IMPDH2PIK3CAPLAU
SCHEMBL16159400 0.83 SCN9A (0.55) SCN9AHDAC4IMPDH2EDNRBEDNRA
SCHEMBL16159582 0.82 SCN9A (0.42) SCN9AHDAC4IMPDH2PIK3CAEDNRB
SCHEMBL16159697 0.82 SCN9A (0.42) SCN9AHDAC4IMPDH2PIK3CAEDNRB
SCHEMBL27607302 0.82 HDAC4 (0.51) SCN9AHDAC4IMPDH2EDNRBEDNRA
SCHEMBL16159479 0.80 SCN9A (0.46) SCN9AHDAC4IMPDH2EDNRBEDNRA
SCHEMBL16159480 0.80 SCN9A (0.43) SCN9AHDAC4IMPDH2PIK3CAEDNRB
SCHEMBL16159625 0.79 SCN9A (0.48) SCN9AHDAC4IMPDH2PIK3CAEDNRB
SCHEMBL8364185 0.79 PIK3CA (0.44) IMPDH2PIK3CAMAP4K4CDK8AXL

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 1007/4885HDAC4 1855/4885IMPDH2 3515/4885

“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.