SCHEMBL21691682

SCHEMBL21691682

N#Cc1ccc(-c2cc(-c3ccc4sc5ccccc5c4c3)cc(-c3cccc4c3sc3ccccc34)c2)c(C#N)c1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.44
STS P08842 1/20 0.35
PRMT5 O14744 1/20 0.35
WDR77 Q9BQA1 1/20 0.35
PRKDC P78527 2/20 0.33
SLC22A12 Q96S37 1/20 0.33
PARP14 Q460N5 1/20 0.33
PIM1 P11309 1/20 0.32
PIM3 Q86V86 1/20 0.32
PIM2 Q9P1W9 1/20 0.32
PRSS12 P56730 1/20 0.32
PDK2 Q15119 2/20 0.31
LIMK1 P53667 1/20 0.31
GPR3 P46089 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
SCHEMBL21692589 0.94 ALOX5 (0.44) ALOX5PRMT5WDR77PRKDCSLC22A12
SCHEMBL21692576 0.94 ALOX5 (0.44) ALOX5PRMT5WDR77PRKDCSLC22A12
SCHEMBL21692603 0.94 ALOX5 (0.44) ALOX5STSPRMT5WDR77PRKDC
SCHEMBL21693001 0.92 STS (0.40) STSPRMT5WDR77SLC22A12PIM3
SCHEMBL21692480 0.92 ALOX5 (0.48) ALOX5STSPRMT5WDR77PRKDC
SCHEMBL21692584 0.91 ALOX5 (0.41) ALOX5PRMT5WDR77PIM1PIM3
SCHEMBL21692372 0.90 ALOX5 (0.45) ALOX5PRKDCSLC22A12PARP14PIM3
SCHEMBL21692379 0.90 ALOX5 (0.45) ALOX5PRKDCSLC22A12PARP14PIM3
SCHEMBL21691673 0.90 ALOX5 (0.49) ALOX5PRKDCPARP14PIM1PIM3
SCHEMBL21693094 0.90 ALOX5 (0.49) ALOX5PRMT5WDR77PRKDCSLC22A12

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 2220/4885STS 4582/4885PRMT5 3517/4885
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 2220/4885STS 4582/4885PRMT5 3517/4885

“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.