SCHEMBL17615530

SCHEMBL17615530

CCN1C(=O)SC[C@H]1C(C)=O

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 1/20 0.38
▸ MMP9 P14780 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ P2RX7 Q99572 3/20 0.31

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
SCHEMBL14117399 0.75 MAPK1 (0.34) MMP2MMP9
SCHEMBL27848662 0.71 P2RX7 (0.37) L3MBTL1P2RX7
SCHEMBL17946424 0.68 P2RX7 (0.51) P2RX7
SCHEMBL13185695 0.65 ACE (0.36) —
SCHEMBL21424968 0.59 ITGB1 (0.39) L3MBTL1P2RX7
SCHEMBL24464081 0.58 — —
SCHEMBL17034428 0.57 ACE (0.37) —
SCHEMBL1587390 0.57 P2RX7 (0.51) P2RX7
SCHEMBL10073516 0.57 — —
SCHEMBL14827922 0.57 P2RX7 (0.43) L3MBTL1P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160287563-A1 Cysteine Prodrugs PROMENTIS PHARMACEUTICALS, INC. (US) 2016-10-06 — — US disclosed
US-9457014-B2 Cysteine prodrugs PROMENTIS PHARMACEUTICALS, INC. (US) 2016-10-04 — — US disclosed
US-20160081987-A1 Cysteine Prodrugs PROMENTIS PHARMACEUTICALS, INC. (US) 2016-03-24 — — 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-20160287563-A1 Cysteine Prodrugs SLC7A11, GCLC, CTH MMP2 2984/4885MMP9 3226/4885TDP1 1007/4885
US-20160081987-A1 Cysteine Prodrugs SLC7A11, GCLC, CTH MMP2 2984/4885MMP9 3226/4885TDP1 1007/4885

“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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