SCHEMBL16159142

SCHEMBL16159142

CC1(C)c2cc(-c3ccc(-c4ncco4)nc3)ccc2-c2ccc(-c3ccc(-c4ncco4)nc3)cc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 1/20 0.37
CCNC P24863 2/20 0.37
CDK8 P49336 2/20 0.37
LTA4H P09960 1/20 0.33
CCNK O75909 1/20 0.33
CDK12 Q9NYV4 1/20 0.33
BRD4 O60885 2/20 0.33
BACE1 P56817 3/20 0.32
BACE2 Q9Y5Z0 2/20 0.32
PDK2 Q15119 2/20 0.32
HSD17B1 P14061 1/20 0.32
HSD17B2 P37059 1/20 0.32
TNKS O95271 1/20 0.31
IMPDH2 P12268 1/20 0.31
ADRA2A P08913 1/20 0.31
ADRA1D P25100 1/20 0.31
ADRA1A P35348 1/20 0.31
ADRA1B P35368 1/20 0.31
MCL1 Q07820 2/20 0.31
CHRNA7 P36544 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
SCHEMBL16159292 0.85 LTA4H (0.43) HPGDSCCNCCDK8LTA4HBRD4
SCHEMBL16159183 0.85 BRD4 (0.36) HPGDSCCNCCDK8LTA4HBRD4
SCHEMBL16159145 0.83 HPGDS (0.40) HPGDSCCNCCDK8LTA4HPDK2
SCHEMBL16159745 0.82 BACE1 (0.41) HPGDSCCNCCDK8LTA4HBRD4
SCHEMBL16159466 0.82 HPGDS (0.41) HPGDSCCNCCDK8LTA4HBRD4
SCHEMBL16159181 0.82 HPGDS (0.43) HPGDSCCNCCDK8LTA4HBRD4
SCHEMBL16159439 0.80 CCNC (0.36) HPGDSCCNCCDK8LTA4HBRD4
SCHEMBL16159378 0.79 HPGDS (0.42) HPGDSCCNCCDK8LTA4HCCNK
SCHEMBL16159432 0.75 PDK2 (0.44) PDK2IMPDH2
SCHEMBL16159375 0.75 HPGDS (0.49) HPGDSCCNCCDK8LTA4HCCNK

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 HPGDS 4461/4885CCNC 707/4885CDK8 3023/4885

“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.