SCHEMBL21709294

SCHEMBL21709294

c1ccc(-c2cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc(-c3cc(-c4ccccc4)cc4c3sc3ccccc34)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNKS O95271 1/20 0.42
TNKS2 Q9H2K2 1/20 0.42
MAPT P10636 3/20 0.41
ALOX5 P09917 1/20 0.39
L3MBTL1 Q9Y468 3/20 0.38
ATM Q13315 2/20 0.38
LIMK1 P53667 2/20 0.36
PIM3 Q86V86 2/20 0.36
GPR3 P46089 1/20 0.35
ADORA2A P29274 2/20 0.34
ADORA1 P30542 2/20 0.34
ALDH1A1 P00352 3/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
HPGD P15428 2/20 0.33
PIM1 P11309 1/20 0.33
PIM2 Q9P1W9 1/20 0.33
RAB9A P51151 2/20 0.33
KDM4E B2RXH2 1/20 0.33
PARP14 Q460N5 1/20 0.32

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
SCHEMBL17425694 0.93 ALOX5 (0.44) TNKSTNKS2MAPTALOX5L3MBTL1
SCHEMBL25645911 0.93 TNKS (0.43) TNKSTNKS2MAPTALOX5L3MBTL1
SCHEMBL25645914 0.93 TNKS (0.43) TNKSTNKS2MAPTALOX5L3MBTL1
SCHEMBL17425450 0.92 ALOX5 (0.46) TNKSTNKS2MAPTALOX5L3MBTL1
SCHEMBL17425679 0.92 TNKS (0.43) TNKSTNKS2MAPTALOX5L3MBTL1
SCHEMBL25645912 0.91 ALOX5 (0.42) TNKSTNKS2MAPTALOX5L3MBTL1
SCHEMBL17425681 0.90 TNKS (0.41) TNKSTNKS2MAPTALOX5L3MBTL1
SCHEMBL17425459 0.90 LIMK1 (0.44) TNKSTNKS2MAPTALOX5L3MBTL1
SCHEMBL23730843 0.90 TNKS (0.43) TNKSTNKS2MAPTALOX5L3MBTL1
SCHEMBL21108866 0.90 TNKS (0.43) TNKSTNKS2MAPTALOX5L3MBTL1

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-20220199911-A1 AN ORGANIC ELECTRONIC ELEMENT COMPRISING COMPOUND FOR ORGANIC ELECTRONIC ELEMENT AND AN ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2022-06-23 US disclosed
WO-2020032424-A1 ORGANIC ELECTRONIC ELEMENT COMPRISING, AS HOST MATERIAL, MIXTURE OF DIFFERENT KINDS OF COMPOUNDS, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2020-02-13 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-20220199911-A1 AN ORGANIC ELECTRONIC ELEMENT COMPRISING COMPOUND FOR ORGANIC ELECTRONIC ELEMENT AND AN ELECTRONIC DEVICE THEREOF ESR1, EML4, OCIAD1 TNKS 3511/4885TNKS2 3653/4885MAPT 1551/4885

“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.