SCHEMBL4877162

SCHEMBL4877162

COc1cccc(C2(CNS(=O)(=O)NC(=O)O)CCC(NC3CCN(Cc4ccccc4)CC3)CC2)c1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 5/20 0.52
MCHR1 Q99705 2/20 0.47
KMT2A Q03164 1/20 0.46
DRD4 P21917 2/20 0.45
CXCR3 P49682 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CHRM2 P08172 2/20 0.44
CHRM1 P11229 2/20 0.44
CHRM3 P20309 2/20 0.44
ACHE P22303 1/20 0.44
CCR8 P51685 2/20 0.43
KCNH2 Q12809 1/20 0.43
CHRM4 P08173 1/20 0.43

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
SCHEMBL4877150 1.00 SIGMAR1 (0.52) SIGMAR1MCHR1KMT2ADRD4CXCR3
SCHEMBL4877592 0.89 SIGMAR1 (0.52) SIGMAR1MCHR1KMT2ADRD4CXCR3
SCHEMBL4877583 0.89 SIGMAR1 (0.52) SIGMAR1MCHR1KMT2ADRD4CXCR3
SCHEMBL4880794 0.88 SIGMAR1 (0.51) SIGMAR1MCHR1KMT2ADRD4CXCR3
SCHEMBL5771453 0.88 SIGMAR1 (0.51) SIGMAR1MCHR1KMT2ADRD4CXCR3
SCHEMBL4880806 0.88 SIGMAR1 (0.51) SIGMAR1MCHR1KMT2ADRD4CXCR3
Hydrochloric Acid SCHEMBL4887063 0.87 SIGMAR1 (0.50) SIGMAR1MCHR1KMT2ADRD4CXCR3
Hydrochloric Acid SCHEMBL4887072 0.87 SIGMAR1 (0.50) SIGMAR1MCHR1KMT2ADRD4CXCR3
SCHEMBL4868269 0.87 SOAT1 (0.40) SIGMAR1KMT2ACHRM2CHRM1CHRM3
SCHEMBL4868281 0.87 SOAT1 (0.40) SIGMAR1KMT2ACHRM2CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080096922-A1 Novel Sulfonamide derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2008-04-24 US disclosed
EP-1736467-A1 NOVEL SULFONAMIDE DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2006-12-27 EP 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-20080096922-A1 Novel Sulfonamide derivative NR4A1, NR4A2, NR4A3 SIGMAR1 298/4885MCHR1 1709/4885KMT2A 1132/4885

“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.