SCHEMBL1648302

SCHEMBL1648302

COC(C)(C)C.Cc1csc(S(=O)(=O)Cl)n1

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TXNRD1 Q16881 1/20 0.39
NOS1 P29475 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL212986 0.88 SMN1; SMN2 (0.41) TXNRD1NOS1SMN1; SMN2
SCHEMBL1085712 0.72 HTR1A (0.39) SMN1; SMN2
SCHEMBL22481778 0.70 SMN1; SMN2 (0.43) TXNRD1NOS1SMN1; SMN2
SCHEMBL9095722 0.69 NOS1 (0.46) TXNRD1NOS1SMN1; SMN2
SCHEMBL30760210 0.67 CA1 (0.43)
SCHEMBL1464870 0.67 ALDH1A1 (0.38) TXNRD1NOS1SMN1; SMN2
SCHEMBL23568545 0.66 ALDH1A1 (0.31)
SCHEMBL23531799 0.66 TXNRD1 (0.33) TXNRD1NOS1SMN1; SMN2
SCHEMBL1465766 0.65 ALDH1A1 (0.36) TXNRD1SMN1; SMN2
SCHEMBL5329734 0.65 CCR4 (0.33)

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
US-8314240-B2 Sulfonamide compounds or salts thereof ASTELLAS PHARMA INC. (JP) 2012-11-20 US disclosed
US-20110201616-A1 SULFONAMIDE COMPOUNDS OR SALTS THEREOF ASTELLAS PHARMA INC. (JP) 2011-08-18 US disclosed
EP-2305641-A1 SULFONAMIDE COMPOUND OR SALT THEREOF Astellas Pharma Inc. (JP) 2011-04-06 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-20110201616-A1 SULFONAMIDE COMPOUNDS OR SALTS THEREOF PTGER1, PTGER2, GPER1 TXNRD1 1157/4885NOS1 1722/4885SMN1; SMN2 1910/4885

“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.