SCHEMBL3608728

SCHEMBL3608728

O=S1(=O)Nc2ccccc2N1c1cccc(F)c1F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 8/20 0.36
HCAR1 Q9BXC0 2/20 0.35
DRD2 P14416 1/20 0.34
DRD3 P35462 1/20 0.34
OPRM1 P35372 2/20 0.33
KDM4E B2RXH2 1/20 0.33
RECQL P46063 1/20 0.33
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
HTT P42858 1/20 0.31
PDE7A Q13946 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 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
SCHEMBL3605620 0.90 PDE7A (0.40) OPRL1OPRM1KDM4ERECQLPDE7A
SCHEMBL3604966 0.88 MEN1 (0.39) OPRL1KDM4ERECQLMEN1KMT2A
SCHEMBL3610877 0.85 OPRL1 (0.40) OPRL1OPRM1KDM4ERECQLLMNA
SCHEMBL4053612 0.84 HCAR1 (0.37) OPRL1HCAR1OPRM1KDM4ERECQL
SCHEMBL3603631 0.79 SLC6A2 (0.41) OPRL1MEN1KMT2APOLBMAPT
SCHEMBL3598276 0.78 SLC6A2 (0.41) OPRL1MEN1KMT2A
SCHEMBL3602880 0.77 SLC6A2 (0.39) OPRL1MEN1KMT2AMGLLPOLB
SCHEMBL3603070 0.76 SLC6A2 (0.40) OPRL1OPRM1KDM4ERECQLMEN1
SCHEMBL3599855 0.76 TP53 (0.42) OPRL1KDM4ELMNAMEN1KMT2A
SCHEMBL3600016 0.76 KDM4E (0.35) OPRL1OPRM1KDM4ERECQLLMNA

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 OPRL1 53/4885HCAR1 1886/4885DRD2 234/4885
US-20080161366-A1 AMINOALKYL SUBSTITUTED ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE SLC6A4, SLC6A2, SLC6A3 OPRL1 55/4885HCAR1 1977/4885DRD2 187/4885
US-20080167303-A1 ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE SLC6A4, SLC6A2, SLC6A3 OPRL1 53/4885HCAR1 1886/4885DRD2 234/4885

“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.