SCHEMBL23487587

SCHEMBL23487587

Cc1ccc(-c2ccc3c4ccc(-c5ccc(C)cc5)cc4n(-c4cc(C#N)cc(-n5c6cc(-c7ccc(C)cc7)ccc6c6ccc(-c7ccc(C)cc7)cc65)c4-c4nc(C)cc(C)n4)c3c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.38
MAPKAPK2 P49137 1/20 0.36
HSD11B1 P28845 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP2A6 P11509 1/20 0.35
IRAK4 Q9NWZ3 1/20 0.35
ABCG2 Q9UNQ0 2/20 0.34
GRM2 Q14416 1/20 0.34
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33
HRH4 Q9H3N8 1/20 0.33
SLC2A1 P11166 1/20 0.32
KMT2A Q03164 1/20 0.32
TP53 P04637 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
SCHEMBL22563564 0.95 CHEK1 (0.41) CHEK1HSD11B1IRAK4ABCG2PIK3CD
SCHEMBL22563570 0.92 ABCG2 (0.43) CHEK1ALDH1A1IRAK4ABCG2KMT2A
SCHEMBL22563560 0.92 IRAK4 (0.36) CHEK1HSD11B1IRAK4ABCG2
SCHEMBL22563588 0.92 CHEK1 (0.36) CHEK1IRAK4ABCG2
SCHEMBL22563366 0.91 MAPKAPK2 (0.38) CHEK1MAPKAPK2HSD11B1ALDH1A1CYP2A6
SCHEMBL19913283 0.90 CHEK1 (0.37) CHEK1MAPKAPK2HSD11B1ALDH1A1CYP2A6
SCHEMBL22563430 0.90 USP14 (0.38) ALDH1A1CYP2A6ABCG2GRM2SLC2A1
SCHEMBL23487779 0.90 ABCG2 (0.38) CHEK1ALDH1A1IRAK4ABCG2KMT2A
SCHEMBL19943041 0.89 CHEK1 (0.39) CHEK1MAPKAPK2HSD11B1ALDH1A1CYP2A6
SCHEMBL22563500 0.89 ABCG2 (0.41) CHEK1ALDH1A1IRAK4ABCG2KMT2A

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 CHEK1 2408/4885MAPKAPK2 1420/4885HSD11B1 2836/4885

“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.