SCHEMBL15094293

SCHEMBL15094293

O=C(O)c1cc(Cl)c(Oc2cccc(Cl)c2Cl)cc1F

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.47
SCN9A Q15858 7/20 0.47
MRGPRX4 Q96LA9 3/20 0.43
HTR1A P08908 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
MEN1 O00255 1/20 0.39
TTR P02766 1/20 0.39
HSP90AA1 P07900 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL28053158 0.79 SLC6A2 (0.45) TSHRSCN9AMRGPRX4HTR1ASLC6A2
SCHEMBL30996881 0.79 TSHR (0.61) TSHRMRGPRX4MAPTKMT2A
SCHEMBL15059548 0.76 CXCL8 (0.44)
SCHEMBL365555 0.76 SLC6A4 (0.44) SCN9AMRGPRX4SLC6A2SLC6A4SLC6A3
SCHEMBL15094056 0.75 SCN9A (0.55) SCN9A
SCHEMBL8348157 0.73 ALDH1A1 (0.47) MRGPRX4MEN1TTRMAPTKMT2A
SCHEMBL28053101 0.73 MEN1 (0.50) HTR1ASLC6A2SLC6A4SLC6A3MEN1
SCHEMBL17244918 0.72 SCN9A (0.51) SCN9AMAPT
SCHEMBL366037 0.72 SCN9A (0.67) SCN9A
SCHEMBL363464 0.72 MRGPRX4 (0.48) TSHRSCN9AMRGPRX4MEN1TTR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2800740-A1 N-AMINOSULFONYL BENZAMIDES Pfizer Limited (GB) 2014-11-12 EP disclosed
WO-2013102826-A1 N-AMINOSULFONYL BENZAMIDES PFIZER LIMITED (GB) 2013-07-11 WO disclosed