SCHEMBL26919628

SCHEMBL26919628

COC(=O)C(CC#N)CSCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.42
▸ METAP2 P50579 1/20 0.42
▸ PPARG P37231 2/20 0.42
▸ PPARA Q07869 2/20 0.42
▸ ACE P12821 2/20 0.42
▸ ANPEP P15144 2/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ GAA P10253 1/20 0.40
▸ HTT P42858 1/20 0.40

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
SCHEMBL7443884 0.81 ANPEP (0.51) KMT2AANPEP
SCHEMBL5422146 0.79 CTSS (0.52) ACE
SCHEMBL2164026 0.77 METAP2 (0.50) KMT2AMETAP2PPARGPPARAACE
SCHEMBL2164032 0.77 METAP2 (0.50) KMT2AMETAP2PPARGPPARAACE
SCHEMBL4141148 0.76 METAP2 (0.52) METAP2PPARGPPARAACEL3MBTL1
SCHEMBL9207368 0.76 METAP2 (0.46) METAP2PPARGPPARAACEL3MBTL1
SCHEMBL1839764 0.76 METAP2 (0.52) METAP2PPARGPPARAACEL3MBTL1
SCHEMBL10980774 0.76 METAP2 (0.46) KMT2AMETAP2PPARGPPARAACE
SCHEMBL2553802 0.76 METAP2 (0.52) METAP2PPARGPPARAACEL3MBTL1
Cyanide SCHEMBL28390031 0.75 METAP2 (0.49) METAP2PPARGPPARAACEANPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4288426-B1 QUINOXALINE DERIVATIVES AND USES THEREOF BLACK DIAMOND THERAPEUTICS INC (US) 2026-02-04 — — EP disclosed
WO-2025226892-A1 SPIROCYCLE-CONTAINING DIAMINOMETHYLENE PYRIMIDINE-2,4,6-TRIONE AGONISTS OF PARATHYROID HORMONE 1 AND INCRETIN RECEPTORS SEPTERNA, INC. (US) 2025-10-30 — — WO disclosed
US-20240368181-A1 QUINOXALINE DERIVATIVES AND USES THEREOF BLACK DIAMOND THERAPEUTICS, INC. (US) 2024-11-07 — — US disclosed
EP-4288426-A1 QUINOXALINE DERIVATIVES AND USES THEREOF Black Diamond Therapeutics, Inc. (US) 2023-12-13 — — EP disclosed
CN-117203202-A Quinoxaline derivative and use thereof 黑钻治疗公司 2023-12-08 — — CN disclosed
WO-2022170122-A1 QUINOXALINE DERIVATIVES AND USES THEREOF BLACK DIAMOND THERAPEUTICS, INC. (US) 2022-08-11 — — 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-20240368181-A1 QUINOXALINE DERIVATIVES AND USES THEREOF NQO2, NQO1, GLS KMT2A 2657/4885METAP2 3682/4885PPARG 2061/4885

“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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