SCHEMBL15420287

SCHEMBL15420287

CCS(=O)(=O)N[C@H]1CCCO[C@@H]1COc1ccc(-n2cc(Cl)cn2)cc1F

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 4/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
MELK Q14680 1/20 0.34
PRKCQ Q04759 1/20 0.33
BRD4 O60885 1/20 0.32
CYP46A1 Q9Y6A2 1/20 0.32
RIPK2 O43353 1/20 0.32
INSR P06213 1/20 0.31
ALK Q9UM73 1/20 0.31
KAT5 Q92993 1/20 0.31
GPR119 Q8TDV5 1/20 0.30
EGFR P00533 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
SCHEMBL21795675 0.93 SCN9A (0.38) SCN9AL3MBTL1MELKPRKCQCYP46A1
SCHEMBL15420693 0.93 SCN9A (0.38) SCN9AL3MBTL1MELKPRKCQCYP46A1
SCHEMBL15420670 0.91 SCN9A (0.36) SCN9AL3MBTL1MELKPRKCQBRD4
SCHEMBL21795637 0.91 SCN9A (0.36) SCN9AL3MBTL1MELKPRKCQBRD4
SCHEMBL15420526 0.90 SCN9A (0.34) SCN9AL3MBTL1MELKPRKCQCYP46A1
SCHEMBL21795647 0.86 RIPK2 (0.35) SCN9ACYP46A1RIPK2INSRALK
SCHEMBL15420148 0.86 RIPK2 (0.35) SCN9ACYP46A1RIPK2INSRALK
SCHEMBL12988551 0.84 KAT5 (0.34) SCN9AMELKPRKCQBRD4CYP46A1
SCHEMBL15420035 0.84 CYP46A1 (0.35) SCN9AL3MBTL1MELKCYP46A1RIPK2
SCHEMBL12989671 0.84 KAT5 (0.34) SCN9AMELKPRKCQBRD4CYP46A1

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 7 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-9527807-B2 Sulfonamide derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-12-27 US 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
US-20140024650-A1 SULFONAMIDE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-01-23 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 SCN9A 648/4885L3MBTL1 4388/4885MELK 2394/4885

“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.