SCHEMBL23487585

SCHEMBL23487585

Cc1cccc(-c2ccc3c(c2)c2cc(-c4cccc(C)c4)ccc2n3-c2cc(C#N)cc(-n3c4ccc(-c5cccc(C)c5)cc4c4cc(-c5cccc(C)c5)ccc43)c2-c2nc(-c3ccccc3)cc(-c3ccccc3)n2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 2/20 0.43
ADORA1 P30542 2/20 0.43
ALDH1A3 P47895 2/20 0.40
KDM4E B2RXH2 4/20 0.37
ABCG2 Q9UNQ0 2/20 0.37
HPGD P15428 2/20 0.37
PPARG P37231 1/20 0.37
NCOA2 Q15596 1/20 0.37
NCOA1 Q15788 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
NCOA3 Q9Y6Q9 1/20 0.37
L3MBTL1 Q9Y468 3/20 0.36
MAPT P10636 2/20 0.36
MAPK14 Q16539 1/20 0.36
CTSS P25774 1/20 0.36
CTSK P43235 1/20 0.36
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36
PTGER4 P35408 1/20 0.36
ABCB1 P08183 1/20 0.35

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
SCHEMBL22563672 0.97 ADORA2A (0.41) ADORA2AADORA1ALDH1A3KDM4EABCG2
SCHEMBL22563480 0.94 ALDH1A3 (0.38) ADORA2AADORA1ALDH1A3KDM4EABCG2
SCHEMBL19913279 0.92 ADORA2A (0.43) ADORA2AADORA1ALDH1A3KDM4EHPGD
SCHEMBL23487715 0.91 KDM4E (0.39) ADORA2AADORA1ALDH1A3KDM4EABCG2
SCHEMBL22563571 0.91 MYC (0.42) ADORA2AADORA1ALDH1A3KDM4EABCG2
SCHEMBL21278737 0.91 ADORA2A (0.40) ADORA2AADORA1ALDH1A3KDM4EABCG2
SCHEMBL23487621 0.91 PTGER4 (0.38) ADORA2AADORA1ALDH1A3KDM4EABCG2
SCHEMBL22563562 0.90 MYC (0.44) ADORA2AALDH1A3KDM4EABCG2ABCB1
SCHEMBL21108019 0.90 PTGER4 (0.40) ADORA2AADORA1ABCG2MAPTMAPK14
SCHEMBL23487689 0.89 ALDH1A1 (0.38) ADORA2AADORA1ALDH1A3KDM4EABCG2

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 1 patent. 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

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 ADORA2A 4354/4885ADORA1 4564/4885ALDH1A3 91/4885

“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.