SCHEMBL3227088

SCHEMBL3227088

NC(=O)[C@H](CSC(c1ccccc1)(c1ccccc1)c1ccccc1)NC(=O)O

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 18/20 0.54
▸ DNMT1 P26358 1/20 0.54

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
SCHEMBL21111324 1.00 KIF11 (0.54) KIF11DNMT1
SCHEMBL21111320 1.00 KIF11 (0.54) KIF11DNMT1
SCHEMBL28653303 0.94 KIF11 (0.49) KIF11DNMT1
SCHEMBL28648933 0.94 KIF11 (0.49) KIF11DNMT1
SCHEMBL14537462 0.88 KIF11 (0.51) KIF11DNMT1
SCHEMBL21084901 0.87 KIF11 (0.60) KIF11DNMT1
SCHEMBL21084902 0.87 KIF11 (0.60) KIF11DNMT1
SCHEMBL21084899 0.87 KIF11 (0.60) KIF11DNMT1
SCHEMBL21084926 0.87 KIF11 (0.60) KIF11DNMT1
SCHEMBL21084900 0.87 KIF11 (0.60) KIF11DNMT1

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
EP-3508476-A1 AMINO MERCAPTAN COMPOUND AND PREPARATION METHOD THEREFOR AND USE THEREOF IN PROTECTION AGAINST RADIATION Inst Of Radiation Medicine Chinese Acad Of Medical Sciences (CN) 2019-07-10 — — EP disclosed
US-20100063013-A1 CATHEPSIN CYSTEINE PROTEASE INHIBITORS MERCK FROSST CANADA LTD. (CA) 2010-03-11 — — 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 (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-20100063013-A1 CATHEPSIN CYSTEINE PROTEASE INHIBITORS CTSS, CTSB, CTSZ KIF11 4198/4885DNMT1 4582/4885

“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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