SCHEMBL3607322

SCHEMBL3607322

O=S1(=O)Nc2c(F)cccc2N1c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA4 P22748 1/20 0.37
CA7 P43166 1/20 0.37
CA9 Q16790 1/20 0.37
PTPN1 P18031 1/20 0.36
LMNA P02545 1/20 0.33
THRB P10828 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
MGLL Q99685 1/20 0.33
SLC6A2 P23975 10/20 0.32
SLC6A4 P31645 6/20 0.32
SLC40A1 Q9NP59 1/20 0.32
SLC6A3 Q01959 7/20 0.31

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
SCHEMBL3610115 0.87 CA12 (0.39) CA12CA1CA2CA4CA7
SCHEMBL3595313 0.77 SLC6A2 (0.38) CA12CA1CA2CA4CA7
SCHEMBL3608942 0.74 PTPN1 (0.36) CA12CA1CA2CA4CA7
SCHEMBL3596885 0.74 PTPN1 (0.41) CA12CA1CA2CA4CA7
SCHEMBL4063463 0.70 SLC6A2 (0.39) CA12CA1CA2CA4CA7
SCHEMBL3610877 0.69 OPRL1 (0.40) LMNATHRBMEN1KMT2AMGLL
SCHEMBL3608555 0.69 SLC6A2 (0.38) LMNATHRBSLC6A2SLC6A3
SCHEMBL4058855 0.69 SLC6A2 (0.41) MGLLSLC6A2
SCHEMBL3604966 0.68 MEN1 (0.39) MEN1KMT2AMGLLSLC6A2SLC6A4
SCHEMBL3602880 0.68 SLC6A2 (0.39) MEN1KMT2AMGLLSLC6A2SLC6A4

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 disclosed
US-7601722-B2 Aryl sulfamide derivatives and methods of their use WYETH (US) 2009-10-13 US disclosed
EP-2061776-A1 ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE Wyeth a Corporation of the State of Delaware (US) 2009-05-27 EP disclosed
US-20080167303-A1 ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE WYETH (US) 2008-07-10 US disclosed
US-20080161366-A1 AMINOALKYL SUBSTITUTED ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE WYETH (US) 2008-07-03 US disclosed
WO-2008073459-A1 ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE WYETH (US) 2008-06-19 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 (3 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 CA12 3705/4885CA1 3058/4885CA2 2878/4885
US-20080161366-A1 AMINOALKYL SUBSTITUTED ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE SLC6A4, SLC6A2, SLC6A3 CA12 3902/4885CA1 3794/4885CA2 2991/4885
US-20080167303-A1 ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE SLC6A4, SLC6A2, SLC6A3 CA12 3705/4885CA1 3058/4885CA2 2878/4885

“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.