SCHEMBL23515898

SCHEMBL23515898

CN1C(=O)c2cccc(-n3c4cc(-c5cc(C#N)cc(C#N)c5)ccc4c4ccc(-c5cc(C#N)cc(C#N)c5)cc43)c2C1=O

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 7/20 0.39
▸ CASP3 P42574 1/20 0.37
▸ BRD4 O60885 3/20 0.35
▸ FLT3 P36888 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ USP2 O75604 1/20 0.34
▸ CASP1 P29466 1/20 0.34
▸ BRCA1 P38398 1/20 0.34
▸ CASP7 P55210 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ CHEK1 O14757 1/20 0.34
▸ BRD1 O95696 1/20 0.34
▸ TAF1 P21675 1/20 0.34
▸ BRPF1 P55201 1/20 0.34
▸ TYMS P04818 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
SCHEMBL23515897 0.96 PGR (0.39) PGRCASP3BRD4FLT3CHEK1
SCHEMBL23515910 0.93 BRD4 (0.42) PGRCASP3BRD4FLT3CHEK1
SCHEMBL23515926 0.92 CHEK1 (0.41) PGRCASP3BRD4FLT3MEN1
SCHEMBL23516288 0.91 BRD4 (0.37) PGRCASP3BRD4MEN1USP2
SCHEMBL23516287 0.89 PGR (0.37) PGRCASP3BRD4FLT3CHEK1
SCHEMBL23515906 0.89 CHEK1 (0.39) PGRCASP3BRD4FLT3CHEK1
SCHEMBL23515911 0.88 CHEK1 (0.39) PGRCASP3BRD4FLT3CHEK1
SCHEMBL19852647 0.87 CASP3 (0.47) CASP3BRD4FLT3MEN1USP2
SCHEMBL23516253 0.85 CASP3 (0.39) CASP3BRD4FLT3CHEK1BRD1
SCHEMBL23516034 0.84 TRPA1 (0.41) —

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-11276825-B2 Organic molecules for use in organic devices CYNORA GMBH (DE) 2022-03-15 — — US disclosed
US-20210184134-A1 ORGANIC MOLECULES FOR USE IN ORGANIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2021-06-17 — — 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 (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-20210184134-A1 ORGANIC MOLECULES FOR USE IN ORGANIC DEVICES CHRM1, C1S, DNMT3L PGR 1964/4885CASP3 2113/4885BRD4 1051/4885
US-11276825-B2 Organic molecules for use in organic devices AOX1, OR10J3, L1CAM PGR 1651/4885CASP3 2340/4885BRD4 3545/4885

“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.

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