SCHEMBL14767784

SCHEMBL14767784

NC1=NS(=O)(=O)Nc2cccc(O[C@H]3CCNC3)c21

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 8/20 0.41
SLC6A2 P23975 8/20 0.41
CHRNB2 P17787 1/20 0.37
CHRNA4 P43681 1/20 0.37
MKNK1 Q9BUB5 1/20 0.37
MKNK2 Q9HBH9 1/20 0.37
HTR2C P28335 3/20 0.37
HTR2B P41595 3/20 0.37
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
TIPARP Q7Z3E1 1/20 0.36
PIM1 P11309 3/20 0.35
PIM2 Q9P1W9 3/20 0.35
PIM3 Q86V86 1/20 0.35

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
SCHEMBL15605543 1.00 HTR1A (0.41) HTR1ASLC6A2CHRNB2CHRNA4MKNK1
SCHEMBL10257945 1.00 HTR1A (0.41) HTR1ASLC6A2CHRNB2CHRNA4MKNK1
SCHEMBL6015953 0.93 HTR1A (0.41) HTR1ASLC6A2CHRNB2CHRNA4
SCHEMBL6015696 0.93 HTR1A (0.41) HTR1ASLC6A2CHRNB2CHRNA4
SCHEMBL6015807 0.93 HRH1 (0.41) HTR1ASLC6A2MKNK1MKNK2SLC6A4
SCHEMBL2421529 0.85 MCHR1 (0.41) MKNK1MKNK2
SCHEMBL12322176 0.85 MCHR1 (0.39) MKNK1MKNK2HTR2CHTR2B
SCHEMBL2421021 0.84 MCHR1 (0.43) MKNK1MKNK2
SCHEMBL620797 0.82 KAT2B (0.38) PIM1PIM2PIM3
SCHEMBL10257428 0.82

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
WO-2013158928-A2 CHEMOSENSORY RECEPTOR LIGAND-BASED THERAPIES ELCELYX THERAPEUTICS, INC. (US) 2013-10-24 WO disclosed
EP-2573559-A1 Modulation of chemosensory receptors and ligands associated Senomyx, Inc. (US) 2013-03-27 EP disclosed
EP-2568287-A2 Modulation of chemosensory receptors and ligands associated Senomyx, Inc. (US) 2013-03-13 EP disclosed