SCHEMBL5997583

SCHEMBL5997583

COC(=O)N(C(CSC(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)OC(C)(C)C)C1c2ccccc2-c2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 18/20 0.41
▸ SIRT2 Q8IXJ6 1/20 0.37
▸ DNMT1 P26358 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
SCHEMBL21195168 0.83 KMT2A (0.35) —
SCHEMBL15106318 0.83 CYP1A2 (0.39) —
SCHEMBL8398612 0.83 CYP1A2 (0.39) —
SCHEMBL28666508 0.83 IDO1 (0.34) —
SCHEMBL28666510 0.83 IDO1 (0.34) —
SCHEMBL6389450 0.82 KIF11 (0.39) KIF11DNMT1
SCHEMBL1491452 0.80 CYP1A2 (0.34) KIF11
SCHEMBL13583914 0.80 ITGA4 (0.32) —
SCHEMBL7338794 0.78 ITGA4 (0.39) —
SCHEMBL7107498 0.77 PTPRC (0.36) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060281926-A1 Synthesis of 2-alkylcysteine via phase transfer catalysis GIMI RAYOMAND H 2006-12-14 — — US disclosed
US-7115769-B2 Synthesis of 2-alkylcysteine via phase transfer catalysis GENZYME CORPORATION (US) 2006-10-03 — — US disclosed
EP-1529037-A2 SYNTHESIS OF 2-ALKYLCYSTEINES, 2-(HYDROXYLATED PHENYL)-4-ALKYLTHIAZOLINE-4-CARBOXYLIC ACIDS AND DERIVATIVES THEREOF Genzyme Corporation (US) 2005-05-11 — — EP disclosed
US-20030236404-A1 Synthesis of 2-alkylcysteine via phase transfer catalysis GENZYME CORPORATION 2003-12-25 — — US disclosed
WO-2003097622-A2 SYNTHESIS OF 2-ALKYLCYSTEINES, 2-(HYDROXYLATED PHENYL)-4-ALKYLTHIAZOLINE-4-CARBOXYLIC ACIDS AND DERIVATIVES THEREOF GENZYME CORPORATION (US) 2003-11-27 — — 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 (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-20030236404-A1 Synthesis of 2-alkylcysteine via phase transfer catalysis DIMT1, ICMT, CNDP2 KIF11 4699/4885SIRT2 1652/4885DNMT1 1291/4885
US-20060281926-A1 Synthesis of 2-alkylcysteine via phase transfer catalysis DIMT1, ICMT, CNDP2 KIF11 4699/4885SIRT2 1652/4885DNMT1 1291/4885

“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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