SCHEMBL15466102

SCHEMBL15466102

CC1(C)CC(OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)CC(C)(C)O1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.34
F2 P00734 1/20 0.30
PRSS1 P07477 1/20 0.30
PRSS2 P07478 1/20 0.30
PRSS3 P35030 1/20 0.30
CA1 P00915 1/20 0.30
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP9 P14780 1/20 0.30
MMP8 P22894 1/20 0.30
MMP13 P45452 1/20 0.30

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
SCHEMBL31178751 0.80 CA2 (0.38) CA2F2PRSS1PRSS2PRSS3
SCHEMBL28474390 0.72 CA2 (0.37) CA2F2PRSS1PRSS2PRSS3
SCHEMBL275290 0.72
SCHEMBL444566 0.71 CA2 (0.44) CA2F2PRSS1PRSS2PRSS3
SCHEMBL27868365 0.70 CA2 (0.42) CA2F2PRSS1PRSS2PRSS3
SCHEMBL13160703 0.70 CA2 (0.35) CA2F2PRSS1PRSS2PRSS3
SCHEMBL4454952 0.67 F2 (0.46) CA2F2PRSS1PRSS2PRSS3
SCHEMBL27991564 0.66 CA2 (0.48) CA2F2PRSS1PRSS2PRSS3
SCHEMBL7057430 0.65 CA2 (0.34) CA2CA1
SCHEMBL3144765 0.63 CA2 (0.40) CA2F2PRSS1PRSS2PRSS3

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-3091006-B1 SULFONYLATION PROCESS USING NONAFLUOROBUTANESULFONYL FLUORIDE JANSSEN PHARMACEUTICA NV (BE) 2018-01-17 EP disclosed
EP-3091006-A1 SULFONYLATION PROCESS USING NONAFLUOROBUTANESULFONYL FLUORIDE Janssen Pharmaceutica N.V. (BE) 2016-11-09 EP disclosed
EP-2882744-B1 PROCESS FOR THE PREPARATION OF C-FMS KINASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2016-09-21 EP disclosed
US-20150232439-A1 PROCESS FOR THE PREPARATION OF C-FMS KINASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2015-08-20 US disclosed
US-9029352-B2 Process for the preparation of C-FMS kinase inhibitors JANSSEN PHARMACEUTICA NV (BE) 2015-05-12 US disclosed
US-20140045789-A1 PROCESS FOR THE PREPARATION OF C-FMS KINASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2014-02-13 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-20150232439-A1 PROCESS FOR THE PREPARATION OF C-FMS KINASE INHIBITORS FLT3, FES, FER CA2 2395/4885F2 221/4885PRSS1 627/4885
US-20140045789-A1 PROCESS FOR THE PREPARATION OF C-FMS KINASE INHIBITORS FLT3, FES, FER CA2 2395/4885F2 221/4885PRSS1 627/4885

“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.