SCHEMBL22563383

SCHEMBL22563383

N#Cc1ccc(-c2ccc3c(c2)c2ccccc2n3-c2cc(-c3nc(-c4ccccc4)cc(-c4ccccc4)n3)cc(-n3c4ccccc4c4cc(-c5ccc(C#N)cc5C#N)ccc43)c2C#N)c(C#N)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SQOR Q9Y6N5 3/20 0.35
ABCG2 Q9UNQ0 2/20 0.35
PTGER4 P35408 1/20 0.35
ADORA1 P30542 5/20 0.34
ADORA2A P29274 4/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
MAPK1 P28482 1/20 0.34
ABCB1 P08183 1/20 0.34
KDM4E B2RXH2 3/20 0.33
HPGD P15428 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
MEN1 O00255 1/20 0.33
PIM1 P11309 1/20 0.33
KMT2A Q03164 1/20 0.33
PPARG P37231 1/20 0.33
NCOA2 Q15596 1/20 0.33
NCOA1 Q15788 1/20 0.33
NCOA3 Q9Y6Q9 1/20 0.33
STS P08842 1/20 0.33
RXFP1 Q9HBX9 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
SCHEMBL21279092 0.97 ABCG2 (0.37) SQORABCG2PTGER4ADORA1ADORA2A
SCHEMBL22563386 0.97 ABCG2 (0.37) SQORABCG2ADORA1ADORA2AL3MBTL1
SCHEMBL21279086 0.94 ABCG2 (0.39) SQORABCG2ADORA1ADORA2AL3MBTL1
SCHEMBL19942696 0.94 PTGER4 (0.35) ABCG2PTGER4MAPK1ABCB1KDM4E
SCHEMBL19909198 0.93 MYC (0.39) SQORABCG2PTGER4ADORA1ADORA2A
SCHEMBL19942695 0.91 ABCG2 (0.36) ABCG2ADORA1ADORA2AABCB1MEN1
SCHEMBL30107743 0.90 ABCG2 (0.36) ABCG2PTGER4MAPK1ABCB1KDM4E
SCHEMBL23487683 0.90 GABRG2 (0.40) SQORADORA1ADORA2AL3MBTL1MAPK1
SCHEMBL19909201 0.90 MYC (0.41) SQORABCG2ADORA1ADORA2AL3MBTL1
SCHEMBL22865569 0.90 ABCG2 (0.35) ABCG2PTGER4MAPK1ABCB1KDM4E

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-20210175434-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2021-06-10 US disclosed
EP-3580300-B1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2020-10-21 EP 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-20210175434-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, OR51E2, OCIAD2 SQOR 412/4885ABCG2 2612/4885PTGER4 1486/4885

“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.