SCHEMBL3598450

SCHEMBL3598450

CNCc1ccc(CN2c3ccccc3N(c3ccccc3F)S2(O)O)cc1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 18/20 0.46
SLC6A3 Q01959 10/20 0.46
SLC6A4 P31645 3/20 0.45
KCNH2 Q12809 2/20 0.38
NCF1 P14598 1/20 0.36
KDM4E B2RXH2 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL3605429 0.89 SLC6A2 (0.44) SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL3598455 0.85 SLC6A2 (0.62) SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL3607965 0.83 SLC6A2 (0.38) SLC6A2SLC6A3SLC6A4KCNH2KDM4E
SCHEMBL3611138 0.78 SLC6A2 (0.47) SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL3611142 0.78 SLC6A2 (0.47) SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL3603758 0.78 SLC6A2 (0.39) SLC6A2SLC6A3SLC6A4KCNH2
Hydrochloric Acid SCHEMBL3612012 0.77 SLC6A2 (0.39) SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL4053531 0.76 SLC6A2 (0.72) SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL3610948 0.75 SLC6A2 (0.49) SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL4054666 0.75 SLC6A2 (0.73) SLC6A2SLC6A3SLC6A4KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100029641-A1 ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE WYETH (US) 2010-02-04 US claimed
US-7601722-B2 Aryl sulfamide derivatives and methods of their use WYETH (US) 2009-10-13 US claimed
US-20080167303-A1 ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE WYETH (US) 2008-07-10 US claimed
US-20100029641-A1 ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE WYETH (US) 2010-02-04 US disclosed
US-7601722-B2 Aryl sulfamide derivatives and methods of their use WYETH (US) 2009-10-13 US disclosed
US-20080167303-A1 ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE WYETH (US) 2008-07-10 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 (2 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-20100029641-A1 ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE SLC6A4, SLC6A2, SLC6A3 SLC6A2 2/4885SLC6A3 3/4885SLC6A4 1/4885
US-20080167303-A1 ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE SLC6A4, SLC6A2, SLC6A3 SLC6A2 2/4885SLC6A3 3/4885SLC6A4 1/4885

“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.