SCHEMBL3547266

SCHEMBL3547266

COCCN1CCN(c2nc(-c3ccc(C(=O)N[C@H](C(=O)N4C[C@@H](O)[C@H]5OCC(=O)[C@H]54)C4CCCC4)cc3)cs2)CC1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSK P43235 19/20 0.59
CTSS P25774 10/20 0.57
CTSL P07711 8/20 0.57
CTSB P07858 2/20 0.46
CTSV O60911 2/20 0.46

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
SCHEMBL3546381 1.00 CTSK (0.59) CTSKCTSSCTSLCTSBCTSV
SCHEMBL3538155 0.99 CTSK (0.58) CTSKCTSSCTSLCTSBCTSV
SCHEMBL3550134 0.99 CTSK (0.58) CTSKCTSSCTSLCTSBCTSV
SCHEMBL3540680 0.93 CTSK (0.58) CTSKCTSSCTSLCTSBCTSV
SCHEMBL3537326 0.93 CTSK (0.58) CTSKCTSSCTSLCTSBCTSV
SCHEMBL3164151 0.93 CTSK (0.58) CTSKCTSSCTSLCTSBCTSV
SCHEMBL3549954 0.93 CTSK (0.58) CTSKCTSSCTSLCTSBCTSV
SCHEMBL3545719 0.93 CTSK (0.58) CTSKCTSSCTSLCTSBCTSV
SCHEMBL3538253 0.93 CTSK (0.58) CTSKCTSSCTSLCTSBCTSV
SCHEMBL3542665 0.92 CTSK (0.58) CTSKCTSSCTSLCTSBCTSV

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7799791-B2 Tetrahydrofuro(3,2-B) pyrrol-3-one derivatives as inhibitors of cysteine proteinases AMURA THERAPEUTICS LIMITED (GB) 2010-09-21 US claimed
US-20090186831-A1 Tetrahydrofuro(3,2-B) pyrrol-3-one derivatives as inhibitors of cysteine proteinases AMURA THERAPEUTICS LIMITED (GB) 2009-07-23 US claimed
US-7799791-B2 Tetrahydrofuro(3,2-B) pyrrol-3-one derivatives as inhibitors of cysteine proteinases AMURA THERAPEUTICS LIMITED (GB) 2010-09-21 US disclosed
US-20090186831-A1 Tetrahydrofuro(3,2-B) pyrrol-3-one derivatives as inhibitors of cysteine proteinases AMURA THERAPEUTICS LIMITED (GB) 2009-07-23 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-20090186831-A1 Tetrahydrofuro(3,2-B) pyrrol-3-one derivatives as inhibitors of cysteine proteinases TMPRSS6, CCR6, MMP8 CTSK 496/4885CTSS 33/4885CTSL 73/4885

“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.