SCHEMBL23516263

SCHEMBL23516263

Cc1cc(C#N)ccc1-c1cccc2c1c1c(-c3ccc(C#N)cc3C)cccc1n2-c1cccc2c1C(=O)N(C)C2=O

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 1/20 0.41
▸ BRD1 O95696 1/20 0.37
▸ TAF1 P21675 1/20 0.37
▸ BRPF1 P55201 1/20 0.37
▸ PDE4A P27815 1/20 0.37
▸ BRD4 O60885 4/20 0.36
▸ EGLN2 Q96KS0 2/20 0.36
▸ CYP11B1 P15538 4/20 0.35
▸ CYP11B2 P19099 4/20 0.35
▸ SLC22A12 Q96S37 1/20 0.34
▸ CREBBP Q92793 2/20 0.34
▸ EGLN1 Q9GZT9 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ KMT2A Q03164 1/20 0.34

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
SCHEMBL23516262 0.93 CASP3 (0.38) CASP3BRD1TAF1BRPF1PDE4A
SCHEMBL23516077 0.85 TYMS (0.41) BRD1TAF1BRPF1PDE4AMEN1
SCHEMBL23516236 0.84 BRD4 (0.42) CASP3BRD4SLC22A12CREBBP
SCHEMBL23516253 0.84 CASP3 (0.39) CASP3BRD1TAF1BRPF1PDE4A
SCHEMBL23516118 0.84 CASP3 (0.39) CASP3BRD1TAF1BRPF1PDE4A
SCHEMBL23516310 0.84 BRD4 (0.40) CASP3BRD4CYP11B2MEN1ALDH1A1
SCHEMBL23515931 0.84 TYMS (0.42) BRD1TAF1BRPF1PDE4AMEN1
SCHEMBL23516285 0.83 CASP3 (0.39) CASP3BRD1TAF1BRPF1BRD4
SCHEMBL23516117 0.83 CASP3 (0.37) CASP3PDE4ABRD4EGLN2
SCHEMBL19848968 0.83 CASP3 (0.37) CASP3PDE4ABRD4CREBBP

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 CASP3 2113/4885BRD1 819/4885TAF1 631/4885
US-11276825-B2 Organic molecules for use in organic devices AOX1, OR10J3, L1CAM CASP3 2340/4885BRD1 3653/4885TAF1 2332/4885

“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.

Send feedback