SCHEMBL1140145

SCHEMBL1140145

CC(Oc1ccc(S(=O)(=O)[C@@H]2CC[C@@H](C(=O)O)C2)c(Cl)c1)C(F)(F)F

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSS P25774 16/20 0.50
CTSL P07711 14/20 0.46
CTSB P07858 2/20 0.46
CTSK P43235 2/20 0.46
LIPE Q05469 1/20 0.37
RORC P51449 2/20 0.36
DHODH Q02127 1/20 0.35

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
SCHEMBL1140149 1.00 CTSS (0.50) CTSSCTSLCTSBCTSKLIPE
SCHEMBL1139337 1.00 CTSS (0.50) CTSSCTSLCTSBCTSKLIPE
SCHEMBL1139340 1.00 CTSS (0.50) CTSSCTSLCTSBCTSKLIPE
SCHEMBL1139342 1.00 CTSS (0.50) CTSSCTSLCTSBCTSKLIPE
SCHEMBL1140147 1.00 CTSS (0.50) CTSSCTSLCTSBCTSKLIPE
SCHEMBL7807911 0.85 CTSS (0.49) CTSSCTSLCTSBCTSK
SCHEMBL1139588 0.84 CTSS (0.50) CTSSCTSLCTSBCTSKRORC
SCHEMBL15678419 0.84 CTSS (0.50) CTSSCTSLCTSBCTSKRORC
SCHEMBL7806573 0.84 CTSS (0.50) CTSSCTSLCTSBCTSKRORC
SCHEMBL1138942 0.84 CTSS (0.50) CTSSCTSLCTSBCTSKRORC

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
EP-2440521-B1 NOVEL CYCLOPENTANE DERIVATIVES HOFFMANN LA ROCHE (CH) 2014-04-30 EP claimed
US-20100317647-A1 NOVEL CYCLOPENTANE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2010-12-16 US claimed
EP-2440521-B1 NOVEL CYCLOPENTANE DERIVATIVES HOFFMANN LA ROCHE (CH) 2014-04-30 EP disclosed
US-7893099-B2 Cyclopentane derivatives HOFFMAN-LA ROCHE INC. (US) 2011-02-22 US disclosed
US-20100317647-A1 NOVEL CYCLOPENTANE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2010-12-16 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-20100317647-A1 NOVEL CYCLOPENTANE DERIVATIVES TBXA2R, ADORA1, CNR1 CTSS 2367/4885CTSL 2122/4885CTSB 1975/4885

“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.