SCHEMBL16159243

SCHEMBL16159243

c1ccc(-n2c3cc(-c4cccc(-c5cncs5)n4)ccc3c3c4ccccc4c(-c4cccc(-c5cncs5)n4)cc32)cc1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.37
PLAUR Q03405 1/20 0.36
PIM1 P11309 4/20 0.34
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PIK3R2 O00459 2/20 0.33
IMPDH2 P12268 1/20 0.32
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
KDR P35968 1/20 0.31
TBXAS1 P24557 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
SCHEMBL16159240 0.88 PIM1 (0.40) ARPLAURPIM1ALDH1A1KDM4E
SCHEMBL16159858 0.85 KDR (0.37) ARPLAURPIM1ALDH1A1KDM4E
SCHEMBL16159082 0.83 KDR (0.36) PLAURPIM1ALDH1A1KDM4ENPC1
SCHEMBL16159664 0.82 RAB9A (0.34) ARALDH1A1KDM4EPIK3R2
SCHEMBL16159259 0.82 ROCK2 (0.37) PIK3R2IMPDH2
SCHEMBL16159213 0.81 PIM1 (0.39) ARPLAURPIM1ALDH1A1KDM4E
SCHEMBL17116473 0.80 IRAK4 (0.35) PIM1
SCHEMBL16159725 0.80 KDR (0.33) PLAURPIM1ALDH1A1KDM4ENPC1
SCHEMBL9887472 0.78 MAPT (0.38) ALDH1A1KDM4ENPC1LMNASMN1; SMN2
SCHEMBL9887237 0.78 CYP11B1 (0.45) NPC1MAPT

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 AR 349/4885PLAUR 4293/4885PIM1 2642/4885

“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.