SCHEMBL15420177

SCHEMBL15420177

CCS(=O)(=O)N[C@H]1CCC(F)(F)C[C@H]1COc1ccc(-c2cc(C)on2)c(F)c1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 2/20 0.32
FFAR4 Q5NUL3 2/20 0.32
HMOX1 P09601 1/20 0.30
CASP3 P42574 1/20 0.30
RAB9A P51151 1/20 0.30
SENP8 Q96LD8 1/20 0.30
SENP7 Q9BQF6 1/20 0.30
SENP6 Q9GZR1 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
SCHEMBL15419882 1.00 SCN9A (0.32) SCN9AFFAR4HMOX1CASP3RAB9A
SCHEMBL15420646 0.92 SCN9A (0.36) SCN9AFFAR4CASP3RAB9ASENP8
SCHEMBL12989429 0.92 SCN9A (0.36) SCN9AFFAR4CASP3RAB9ASENP8
SCHEMBL12987072 0.91 SCN9A (0.32) SCN9AFFAR4
SCHEMBL12987074 0.91 SCN9A (0.32) SCN9AFFAR4
SCHEMBL15420288 0.88 CXCR1 (0.35) RAB9A
SCHEMBL15420286 0.88 CXCR1 (0.35) RAB9A
SCHEMBL15420893 0.85 SCN9A (0.33) SCN9AFFAR4HMOX1CASP3RAB9A
SCHEMBL15420487 0.83 SCN9A (0.35) SCN9AFFAR4
SCHEMBL15420490 0.83 SCN9A (0.35) SCN9AFFAR4

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 SCN9A 648/4885FFAR4 277/4885HMOX1 4141/4885

“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.