SCHEMBL3604138

SCHEMBL3604138

COc1cc(F)ccc1N1c2ccccc2NS1(=O)=O

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
GFER P55789 1/20 0.36
DRD2 P14416 2/20 0.35
DRD4 P21917 1/20 0.35
HCRTR2 O43614 3/20 0.35
HTR7 P34969 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PTPN1 P18031 1/20 0.34
HCRTR1 O43613 2/20 0.34
MGLL Q99685 1/20 0.34
ALDH1A1 P00352 2/20 0.34
P2RX7 Q99572 1/20 0.33
KDM4E B2RXH2 1/20 0.33
PKM P14618 1/20 0.33
HTR1A P08908 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
DRD3 P35462 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
SCHEMBL4060353 0.87 MGLL (0.44) MEN1KMT2ADRD2PTPN1MGLL
SCHEMBL3600170 0.82 HCAR1 (0.36) HTR7ALDH1A1P2RX7KDM4EPKM
SCHEMBL3598276 0.82 SLC6A2 (0.41) MEN1KMT2A
SCHEMBL3603631 0.80 SLC6A2 (0.41) MEN1KMT2AL3MBTL1MAPT
SCHEMBL3617303 0.80 MEN1 (0.42) MEN1KMT2AHCRTR2P2RX7
SCHEMBL4057185 0.79 MAPT (0.41) MEN1KMT2AHCRTR2L3MBTL1PTPN1
SCHEMBL3604395 0.75 HCAR1 (0.41) P2RX7KDM4E
SCHEMBL3608555 0.74 SLC6A2 (0.38) KDM4EMAPT
SCHEMBL3600016 0.74 KDM4E (0.35) ALDH1A1KDM4EMAPTHTT
SCHEMBL3604966 0.74 MEN1 (0.39) MEN1KMT2AMGLLALDH1A1KDM4E

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 MEN1 3968/4885KMT2A 1521/4885GFER 1124/4885
US-20080161366-A1 AMINOALKYL SUBSTITUTED ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE SLC6A4, SLC6A2, SLC6A3 MEN1 4156/4885KMT2A 1555/4885GFER 826/4885
US-20080167303-A1 ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE SLC6A4, SLC6A2, SLC6A3 MEN1 3968/4885KMT2A 1521/4885GFER 1124/4885

“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.