SCHEMBL4016855

SCHEMBL4016855

CCCCCCCCCCCCNS(=O)(=O)c1ccc(CN(Cc2cccc([N+](=O)[O-])c2)C(=O)C(=O)O)s1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
TSHR P16473 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CYP1A2 P05177 2/20 0.39
CYP2C19 P33261 2/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
TBXA2R P21731 5/20 0.38
F13A1 P00488 1/20 0.38
MCL1 Q07820 1/20 0.38
MAOA P21397 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
XBP1 P17861 1/20 0.38
MAPK1 P28482 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
GRM8 O00222 2/20 0.37
GRM4 Q14833 2/20 0.37

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
SCHEMBL1852104 0.87 KMT2A (0.50) MEN1KMT2ATSHRHTTSMN1; SMN2
SCHEMBL1856431 0.86 SMN1; SMN2 (0.50) MEN1KMT2ATSHRHTTSMN1; SMN2
SCHEMBL1853214 0.85 TSHR (0.43) MEN1KMT2ATSHRHTTSMN1; SMN2
SCHEMBL1853216 0.85 SMN1; SMN2 (0.44) MEN1KMT2ATSHRHTTSMN1; SMN2
SCHEMBL1854854 0.84 SMN1; SMN2 (0.42) MEN1KMT2ATSHRHTTSMN1; SMN2
SCHEMBL4016045 0.84 SMN1; SMN2 (0.42) MEN1KMT2ATSHRHTTSMN1; SMN2
SCHEMBL1855640 0.81 SMN1; SMN2 (0.47) MEN1KMT2ATSHRHTTSMN1; SMN2
SCHEMBL1853649 0.81 ALDH1A1 (0.46) MEN1KMT2ATSHRHTTSMN1; SMN2
SCHEMBL1853475 0.80 MEN1 (0.47) MEN1KMT2ATSHRHTTSMN1; SMN2
SCHEMBL1854689 0.79 SMN1; SMN2 (0.44) MEN1KMT2ATSHRHTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090018169-A1 Sulfonamide Derivatives for the Treatment of Bacterial Infections LABORATOIRES SERONO SA (CH) 2009-01-15 US claimed
EP-1986637-A1 SULFONAMIDE DERIVATIVES FOR THE TREATMENT OF BACTERIAL INFECTIONS Laboratoires Serono SA (CH) 2008-11-05 EP claimed
WO-2007093557-A1 SULFONAMIDE DERIVATIVES FOR THE TREATMENT OF BACTERIAL INFECTIONS LABORATOIRES SERONO S.A. (CH) 2007-08-23 WO claimed
US-20090018169-A1 Sulfonamide Derivatives for the Treatment of Bacterial Infections LABORATOIRES SERONO SA (CH) 2009-01-15 US disclosed
WO-2007093557-A1 SULFONAMIDE DERIVATIVES FOR THE TREATMENT OF BACTERIAL INFECTIONS LABORATOIRES SERONO S.A. (CH) 2007-08-23 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-20090018169-A1 Sulfonamide Derivatives for the Treatment of Bacterial Infections STS, TST, SULT1A1 MEN1 2947/4885KMT2A 2981/4885TSHR 1632/4885

“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.