SCHEMBL12987372

SCHEMBL12987372

CS(=O)(=O)NC1CCOCC1COc1ccc(-c2ccc(F)cn2)cc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRIA2 P42262 3/20 0.46
GRM5 P41594 4/20 0.37
SMO Q99835 1/20 0.36
XDH P47989 1/20 0.36
GPR183 P32249 1/20 0.34
GPR119 Q8TDV5 1/20 0.34
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
CYP4F2 P78329 2/20 0.32
CYP4A11 Q02928 2/20 0.32
SCN9A Q15858 1/20 0.32
HCRTR2 O43614 3/20 0.32
MCHR1 Q99705 1/20 0.32

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
SCHEMBL15441136 1.00 GRIA2 (0.46) GRIA2GRM5SMOXDHGPR183
SCHEMBL15420813 0.92 GRIA2 (0.48) GRIA2GRM5SMOXDHGPR183
SCHEMBL15441034 0.91 GRIA2 (0.46) GRIA2GRM5XDHGPR183GPR119
SCHEMBL12987133 0.91 GRIA2 (0.46) GRIA2GRM5XDHGPR183GPR119
SCHEMBL15440983 0.90 GRIA2 (0.43) GRIA2GRM5XDHGPR183GPR119
SCHEMBL12988153 0.90 GRIA2 (0.43) GRIA2GRM5XDHGPR183GPR119
SCHEMBL12987282 0.89 GRIA2 (0.38) GRIA2SMOXDHGPR183GPR119
SCHEMBL15420203 0.89 GRIA2 (0.38) GRIA2SMOXDHGPR183GPR119
SCHEMBL15420498 0.88 HCRTR2 (0.35) GRIA2GRM5XDHHCRTR2
SCHEMBL15420219 0.88 PPARD (0.41) GRIA2SMOXDHSCN9AMCHR1

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-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
EP-2694472-A2 SULFONAMIDE DERIVATIVE AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2014-02-12 EP disclosed
US-20140024650-A1 SULFONAMIDE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-01-23 US disclosed
WO-2012137982-A9 SULFONAMIDE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-02-14 WO disclosed
WO-2012137982-A2 SULFONAMIDE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-10-11 WO 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 GRIA2 12/4885GRM5 9/4885SMO 244/4885

“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.