SCHEMBL4058855

SCHEMBL4058855

O=S1(=O)Nc2ccccc2N1c1cccc(F)c1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.41
FAAH O00519 1/20 0.39
MGLL Q99685 1/20 0.39
MAPT P10636 2/20 0.37
ALDH1A1 P00352 2/20 0.37
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37
ALOX5 P09917 2/20 0.35
METAP2 P50579 1/20 0.35
OPRL1 P41146 2/20 0.35
NPSR1 Q6W5P4 1/20 0.34
KEAP1 Q14145 1/20 0.33
RAB9A P51151 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
IDO1 P14902 1/20 0.33
TDO2 P48775 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
SCHEMBL4376262 0.88 OPRL1 (0.36) SLC6A2MAPTOPRL1
SCHEMBL4065273 0.83 ACHE (0.39) SLC6A2FAAHMGLLMAPTALDH1A1
SCHEMBL3608555 0.83 SLC6A2 (0.38) SLC6A2MAPTOPRL1RAB9A
SCHEMBL4057026 0.82 ALDH1A1 (0.43) MAPTALDH1A1GAAALOX5
SCHEMBL3596885 0.82 PTPN1 (0.41) SLC6A2OPRL1
SCHEMBL3607587 0.82 SLC6A2 (0.41) SLC6A2ALDH1A1OPRL1RAB9A
SCHEMBL4059648 0.82 SLC6A2 (0.42) SLC6A2MGLLMAPTALDH1A1GAA
SCHEMBL4064812 0.82 MGLL (0.39) MGLLMAPTALDH1A1POLBGAA
SCHEMBL3603631 0.80 SLC6A2 (0.41) SLC6A2MAPTPOLBOPRL1
SCHEMBL4063463 0.80 SLC6A2 (0.39) SLC6A2MAPTALDH1A1IDO1

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
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-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 (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-20080161366-A1 AMINOALKYL SUBSTITUTED ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE SLC6A4, SLC6A2, SLC6A3 SLC6A2 2/4885FAAH 137/4885MGLL 697/4885

“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.