SCHEMBL15420108

SCHEMBL15420108

CC(C)(C)OC(=O)NC1CCC(F)(F)CC1CO

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RORC P51449 2/20 0.36
BTK Q06187 1/20 0.36
EPHX1 P07099 1/20 0.35
CTSK P43235 2/20 0.34
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
KDM1A O60341 2/20 0.34
HSD11B1 P28845 1/20 0.33
MAOB P27338 2/20 0.33
MAOA P21397 1/20 0.33
GAA P10253 2/20 0.33
MEN1 O00255 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 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
SCHEMBL15420110 1.00 RORC (0.36) RORCBTKEPHX1CTSKNFKB1
SCHEMBL26253780 1.00 RORC (0.36) RORCBTKEPHX1CTSKNFKB1
SCHEMBL26253864 0.89 CTSK (0.36) RORCBTKEPHX1CTSKNFKB1
SCHEMBL20063805 0.84 BTK (0.40) RORCBTKCTSKNFKB1NFKB2
SCHEMBL20095940 0.84 BTK (0.40) RORCBTKCTSKNFKB1NFKB2
SCHEMBL26253688 0.84 BTK (0.36) RORCBTKEPHX1CTSKNFKB1
SCHEMBL26253683 0.84 BTK (0.36) RORCBTKEPHX1CTSKNFKB1
SCHEMBL15420199 0.81 BTK (0.47) RORCBTKCTSKNFKB1NFKB2
SCHEMBL20959100 0.81 BTK (0.47) RORCBTKCTSKNFKB1NFKB2
SCHEMBL12989321 0.81 BTK (0.47) RORCBTKCTSKNFKB1NFKB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2694472-B1 SULFONAMIDE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICALS CO (JP) 2020-03-11 EP disclosed
US-9527807-B2 Sulfonamide derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-12-27 US disclosed
US-20140024650-A1 SULFONAMIDE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-01-23 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-20140024650-A1 SULFONAMIDE DERIVATIVE AND USE THEREOF GRIN2A, GRIN2B, SLC1A2 RORC 1197/4885BTK 774/4885EPHX1 1152/4885

“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.