SCHEMBL3034859

SCHEMBL3034859

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nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSS P25774 17/20 0.58
CTSK P43235 15/20 0.58
CTSL P07711 2/20 0.52
CTSB P07858 2/20 0.52
CAPN1 P07384 1/20 0.52

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
SCHEMBL14471618 0.88 CTSS (0.60) CTSSCTSKCTSLCTSBCAPN1
SCHEMBL24648713 0.88 CTSS (0.60) CTSSCTSKCTSLCTSBCAPN1
SCHEMBL30720056 0.88 CTSS (0.55) CTSSCTSKCTSLCTSBCAPN1
SCHEMBL18975436 0.88 CAPN1 (0.59) CTSSCTSKCTSLCTSBCAPN1
SCHEMBL30797986 0.86 CTSS (0.49) CTSSCTSKCTSLCTSB
SCHEMBL30797870 0.86 CTSS (0.49) CTSSCTSKCTSLCTSB
SCHEMBL15259727 0.85 CTSK (0.59) CTSSCTSKCTSLCTSBCAPN1
SCHEMBL8239753 0.85 CTSS (0.72) CTSSCTSKCTSLCTSBCAPN1
SCHEMBL1486220 0.85 CTSS (0.50) CTSSCTSKCTSLCTSB
SCHEMBL688341 0.85 CTSS (0.50) CTSSCTSKCTSLCTSB

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-2049104-B1 PYRROLIDINONE ANILINES AS PROGESTERONE RECEPTOR MODULATORS GLAXOSMITHKLINE LLC (US) 2012-09-19 EP disclosed
US-7816395-B2 Pyrrolidinone anilines as progesterone receptor modulators GLAXOSMITHKLINE LLC (US) 2010-10-19 US disclosed
US-20100210706-A1 PYRROLIDINONE ANILINES AS PROGESTERONE RECEPTOR MODULATORS SMITHKLINE BEECHAM CORPORATION (US) 2010-08-19 US disclosed
EP-2049104-A2 PYRROLIDINONE ANILINES AS PROGESTERONE RECEPTOR MODULATORS SmithKline Beecham Corporation (US) 2009-04-22 EP disclosed
WO-2008021796-A2 PYRROLIDINONE ANILINES AS PROGESTERONE RECEPTOR MODULATORS SMITHKLINE BEECHAM CORPORATION (US) 2008-02-21 WO disclosed
US-20080039517-A1 PYRROLIDINONE ANILINES AS PROGESTERONE RECEPTOR MODULATORS GLAXOSMITHKLINE LLC 2008-02-14 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-20080039517-A1 PYRROLIDINONE ANILINES AS PROGESTERONE RECEPTOR MODULATORS PGR, PGRMC2, PGRMC1 CTSS 4230/4885CTSK 4301/4885CTSL 4194/4885
US-20100210706-A1 PYRROLIDINONE ANILINES AS PROGESTERONE RECEPTOR MODULATORS PGR, PGRMC2, PGRMC1 CTSS 4230/4885CTSK 4301/4885CTSL 4194/4885

“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.