SCHEMBL21693071

SCHEMBL21693071

N#Cc1cccc(-c2cc(-c3cccc4c3sc3ccccc34)cc(-c3cccc4c3sc3ccccc34)c2)c1C#N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.50
PARP14 Q460N5 1/20 0.39
SLC22A12 Q96S37 1/20 0.36
PRKDC P78527 5/20 0.36
SLC9A1 P19634 2/20 0.34
GPR3 P46089 1/20 0.34
PIK3CD O00329 2/20 0.34
PIK3CB P42338 2/20 0.34
BRD4 O60885 1/20 0.34
PIK3CA P42336 1/20 0.34
MTOR P42345 1/20 0.34
PIK3CG P48736 1/20 0.34
KCNH2 Q12809 1/20 0.34
BRDT Q58F21 1/20 0.34
MCL1 Q07820 1/20 0.33
TNKS O95271 1/20 0.33
TNKS2 Q9H2K2 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HIF1A Q16665 1/20 0.33
CA1 P00915 1/20 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
SCHEMBL21693065 0.90 ALOX5 (0.54) ALOX5PARP14SLC22A12PRKDCSLC9A1
SCHEMBL21691655 0.89 ALOX5 (0.52) ALOX5PARP14SLC22A12PRKDCSLC9A1
SCHEMBL21691736 0.88 ALOX5 (0.40) ALOX5PARP14SLC22A12PRKDCPIK3CD
SCHEMBL21692487 0.88 ALOX5 (0.51) ALOX5PARP14SLC22A12PRKDCSLC9A1
SCHEMBL21691656 0.88 ALOX5 (0.51) ALOX5PARP14SLC22A12PRKDCSLC9A1
SCHEMBL21691585 0.88 ALOX5 (0.51) ALOX5PARP14SLC22A12PRKDCSLC9A1
SCHEMBL21691570 0.87 ALOX5 (0.48) ALOX5PARP14SLC22A12PRKDCSLC9A1
SCHEMBL21692332 0.86 ALOX5 (0.50) ALOX5PARP14SLC22A12PRKDCSLC9A1
SCHEMBL21691582 0.85 ALOX5 (0.52) ALOX5PARP14SLC22A12PRKDCTNKS
SCHEMBL21691562 0.85 ALOX5 (0.46) ALOX5PARP14SLC22A12PRKDCSLC9A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11053228-B2 Condensed cyclic compound, composition including the condensed cyclic compound, and organic light-emitting device including the condensed cyclic compound SAMSUNG ELECTRONICS CO., LTD. (KR) 2021-07-06 US disclosed
US-20200031812-A1 CONDENSED CYCLIC COMPOUND, COMPOSITION INCLUDING THE CONDENSED CYCLIC COMPOUND, AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE CONDENSED CYCLIC COMPOUND SAMSUNG SDI CO., LTD. (KR) 2020-01-30 US 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 (2 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-11053228-B2 Condensed cyclic compound, composition including the condensed cyclic compound, and organic light-emitting device including the condensed cyclic compound CCNL2, ARL1, CRY1 ALOX5 2220/4885PARP14 1715/4885SLC22A12 3782/4885
US-20200031812-A1 CONDENSED CYCLIC COMPOUND, COMPOSITION INCLUDING THE CONDENSED CYCLIC COMPOUND, AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE CONDENSED CYCLIC COMPOUND CCNL2, ARL1, CRY1 ALOX5 2220/4885PARP14 1715/4885SLC22A12 3782/4885

“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.