SCHEMBL1139664

SCHEMBL1139664

N#CCOC(=O)[C@]1(C(N)=O)C[C@H](S(=O)(=O)c2ccc(F)cc2Cl)C[C@H]1COc1ccc(F)cc1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 3/20 0.38
CTSS P25774 16/20 0.37
CTSL P07711 9/20 0.37
HSD11B1 P28845 1/20 0.33

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
SCHEMBL1138734 1.00 TRPV4 (0.38) TRPV4CTSSCTSLHSD11B1
SCHEMBL1140240 1.00 TRPV4 (0.38) TRPV4CTSSCTSLHSD11B1
SCHEMBL1140335 0.92 CTSS (0.38) CTSSCTSL
SCHEMBL1139462 0.92 CTSS (0.38) CTSSCTSL
SCHEMBL1139440 0.87 CTSS (0.38) TRPV4CTSS
SCHEMBL1139916 0.85 CTSS (0.39) CTSSCTSL
SCHEMBL1139504 0.85 CTSS (0.39) CTSSCTSL
SCHEMBL1139773 0.85 CTSS (0.39) CTSSCTSL
SCHEMBL1139149 0.78 CTSS (0.41) CTSSCTSL
SCHEMBL1139131 0.78 CTSS (0.41) CTSSCTSL

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-2440521-B1 NOVEL CYCLOPENTANE DERIVATIVES HOFFMANN LA ROCHE (CH) 2014-04-30 EP claimed
US-7893099-B2 Cyclopentane derivatives HOFFMAN-LA ROCHE INC. (US) 2011-02-22 US 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 TRPV4 1642/4885CTSS 2367/4885CTSL 2122/4885

“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.