SCHEMBL25030928

SCHEMBL25030928

C#CCNc1ccc(C(=O)NC)cc1C#N

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 2/20 0.42
▸ RECQL P46063 1/20 0.38
▸ PLK1 P53350 3/20 0.37
▸ HDAC8 Q9BY41 2/20 0.37
▸ HDAC6 Q9UBN7 2/20 0.37
▸ HDAC2 Q92769 1/20 0.37
▸ ABCC9 O60706 1/20 0.36
▸ ABCC8 Q09428 1/20 0.36
▸ KCNJ11 Q14654 1/20 0.36
▸ KCNJ8 Q15842 1/20 0.36
▸ PLAU P00749 1/20 0.36
▸ AR P10275 1/20 0.36
▸ BRD4 O60885 1/20 0.36
▸ PARP1 P09874 1/20 0.35
▸ XDH P47989 1/20 0.35
▸ CDK1 P06493 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ SMN1; SMN2 Q16637 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
SCHEMBL23144425 0.82 PLK1 (0.41) PLK1HDAC8HDAC6HDAC2PLAU
SCHEMBL29811759 0.82 PLK1 (0.41) PLK1HDAC8HDAC6HDAC2PLAU
SCHEMBL26376285 0.81 TAS1R3 (0.40) PLK1HDAC8HDAC6HDAC2PLAU
SCHEMBL31104567 0.80 HDAC6 (0.46) PLK1HDAC8HDAC6HDAC2PLAU
SCHEMBL30871621 0.80 PYGL (0.40) PLK1HDAC8HDAC6HDAC2PLAU
SCHEMBL30871458 0.80 PLK1 (0.46) PLK1HDAC8HDAC6HDAC2PLAU
SCHEMBL25327016 0.78 TERT (0.41) PLK1HDAC8HDAC6HDAC2PLAU
SCHEMBL23143758 0.78 PYGL (0.47) LRRK2PLK1BRD4HPGDSMN1; SMN2
SCHEMBL29811439 0.78 PYGL (0.47) LRRK2PLK1BRD4HPGDSMN1; SMN2
SCHEMBL30871297 0.77 CYP1A2 (0.41) PLK1HTT

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4676602-A1 COMPOUNDS TARGETING MUTATIONS IN P53 AND USES THEREOF Merck Sharp & Dohme LLC (US) 2026-01-14 — — EP disclosed
US-20240400591-A1 COMPOUNDS TARGETING MUTANT OF P53 JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2024-12-05 — — US disclosed
WO-2024187153-A1 COMPOUNDS TARGETING MUTATIONS IN P53 AND USES THEREOF MERCK SHARP & DOHME LLC (US) 2024-09-12 — — WO disclosed
EP-4384510-A1 COMPOUNDS TARGETING MUTANT OF P53 Jacobio Pharmaceuticals Co., Ltd. (CN) 2024-06-19 — — EP disclosed
CN-117813295-A Compounds targeting p53 mutants 北京加科思新药研发有限公司 2024-04-02 — — CN disclosed
WO-2023016434-A1 COMPOUNDS TARGETING MUTANT OF P53 JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2023-02-16 — — WO disclosed
WO-2023016434-A1 COMPOUNDS TARGETING MUTANT OF P53 JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2023-02-16 — — WO 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-20240400591-A1 COMPOUNDS TARGETING MUTANT OF P53 TP53, TP53BP1, MDM2 LRRK2 1073/4885RECQL 71/4885PLK1 109/4885

“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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