SCHEMBL16159082

SCHEMBL16159082

c1ccc(-n2c3cc(-c4cccc(-c5cncs5)c4)ccc3c3c4ccccc4c(-c4cccc(-c5cncs5)c4)cc32)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.36
PIM1 P11309 1/20 0.35
PLAUR Q03405 1/20 0.35
CD38 P28907 6/20 0.34
DYRK1A Q13627 2/20 0.33
RORC P51449 1/20 0.33
PIK3CD O00329 1/20 0.33
KDM4E B2RXH2 2/20 0.32
NPC1 O15118 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
RET P07949 1/20 0.31
TBXAS1 P24557 1/20 0.31
IMPDH2 P12268 1/20 0.31
PRMT5 O14744 1/20 0.31
WDR77 Q9BQA1 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
DYRK2 Q92630 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
SCHEMBL16159858 0.93 KDR (0.37) KDRPIM1PLAURCD38DYRK1A
SCHEMBL16159725 0.90 KDR (0.33) KDRPIM1PLAURCD38DYRK1A
SCHEMBL16159084 0.87 KDR (0.42) KDRPIM1PLAURCD38DYRK1A
SCHEMBL16159213 0.85 PIM1 (0.39) KDRPIM1PLAURCD38PIK3CD
SCHEMBL9887459 0.83 CYP11B1 (0.40) ALDH1A1L3MBTL1
SCHEMBL16159243 0.83 AR (0.37) KDRPIM1PLAURKDM4ENPC1
SCHEMBL9887474 0.83 MEN1 (0.41) DYRK1AKDM4EALDH1A1IMPDH2ATM
SCHEMBL16159848 0.82 KDR (0.44) KDRPIM1PLAURCD38DYRK1A
SCHEMBL16159339 0.80 SCN9A (0.42) RORCKDM4ESMN1; SMN2ATML3MBTL1
SCHEMBL16159290 0.80 PDPK1 (0.42) KDRRORCPIK3CDKDM4EALDH1A1

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 KDR 1398/4885PIM1 2642/4885PLAUR 4293/4885

“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.