SCHEMBL22135490

SCHEMBL22135490

c1ccc(-c2nc(-c3cccc4c3sc3c(-c5cccc6c5sc5ccccc56)cccc34)nc(-n3c4ccccc4c4ccccc43)n2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.40
PARP14 Q460N5 1/20 0.38
PRKDC P78527 7/20 0.37
PIK3CD O00329 2/20 0.37
PIK3CB P42338 2/20 0.37
LIMK1 P53667 2/20 0.33
BRD4 O60885 1/20 0.33
PIK3CA P42336 1/20 0.33
MTOR P42345 1/20 0.33
PIK3CG P48736 1/20 0.33
KCNH2 Q12809 1/20 0.33
BRDT Q58F21 1/20 0.33
TSHR P16473 2/20 0.32
ADORA2A P29274 2/20 0.32
ADORA1 P30542 2/20 0.32
TNKS O95271 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
ALOX15 P16050 1/20 0.32
ADORA2B P29275 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
SCHEMBL16811135 0.98 ALOX5 (0.41) ALOX5PARP14PRKDCPIK3CDPIK3CB
SCHEMBL16811216 0.95 ALOX5 (0.42) ALOX5PARP14PRKDCPIK3CDPIK3CB
SCHEMBL22737781 0.92 ALOX5 (0.45) ALOX5PARP14PRKDCPIK3CDPIK3CB
SCHEMBL22737790 0.91 ALOX5 (0.32) ALOX5PARP14PRKDCPIK3CDPIK3CB
SCHEMBL21965619 0.91 ALOX5 (0.42) ALOX5PARP14PRKDCPIK3CDPIK3CB
SCHEMBL16811301 0.91 ALOX5 (0.41) ALOX5PARP14PRKDCPIK3CDPIK3CB
SCHEMBL20988518 0.91 ALOX5 (0.38) ALOX5PARP14PRKDCPIK3CDPIK3CB
SCHEMBL24303523 0.90 ALOX5 (0.46) ALOX5PARP14PRKDCPIK3CDPIK3CB
SCHEMBL24153851 0.90 ALOX5 (0.39) ALOX5PARP14PRKDCPIK3CDPIK3CB
SCHEMBL24303618 0.90 ALOX5 (0.46) ALOX5PARP14PRKDCPIK3CDPIK3CB

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-11459316-B2 Compound for organic optoelectronic device, composition for organic optoelectronic device, organic optoelectronic device, and display device SAMSUNG SDI CO., LTD. (KR) 2022-10-04 US disclosed
US-20200377489-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2020-12-03 US disclosed
WO-2020130509-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME 두산솔루스 주식회사 2020-06-25 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 (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-20200377489-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE OCIAD1, OCIAD2, OXER1 ALOX5 395/4885PARP14 4868/4885PRKDC 3103/4885
US-11459316-B2 Compound for organic optoelectronic device, composition for organic optoelectronic device, organic optoelectronic device, and display device OCIAD1, OCIAD2, OXER1 ALOX5 395/4885PARP14 4868/4885PRKDC 3103/4885

“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.