SCHEMBL6196441

SCHEMBL6196441

Cc1cc(NC(=O)NCCN2CCC(NS(=O)(=O)c3cccc(Cl)c3)CC2)c2ccccc2n1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 5/20 0.58
DRD2 P14416 7/20 0.55
HTR2A P28223 4/20 0.55
ADRA2A P08913 1/20 0.55
SLC6A2 P23975 1/20 0.55
HTR2C P28335 1/20 0.55
SLC6A4 P31645 1/20 0.55
TMEM97 Q5BJF2 1/20 0.55
SIGMAR1 Q99720 1/20 0.55
HTR7 P34969 13/20 0.52
HTR1A P08908 11/20 0.52
HTR6 P50406 6/20 0.49
IGF1R P08069 1/20 0.44
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL4862881 0.95 UTS2R (0.55) UTS2RDRD2HTR2AADRA2ASLC6A2
SCHEMBL4862789 0.92 UTS2R (0.58) UTS2RDRD2HTR2AADRA2ASLC6A2
SCHEMBL6196906 0.92 UTS2R (0.58) UTS2RDRD2HTR2AADRA2ASLC6A2
SCHEMBL4862731 0.91 UTS2R (0.56) UTS2RDRD2HTR2AADRA2ASLC6A2
SCHEMBL6195553 0.91 UTS2R (0.56) UTS2RDRD2HTR2AADRA2ASLC6A2
SCHEMBL4857429 0.91 UTS2R (0.56) UTS2RDRD2HTR2AADRA2ASLC6A2
SCHEMBL6198922 0.91 UTS2R (0.56) UTS2RDRD2HTR2AADRA2ASLC6A2
SCHEMBL6198319 0.89 UTS2R (0.55) UTS2RDRD2HTR2AADRA2ASLC6A2
SCHEMBL6195118 0.89 UTS2R (0.56) UTS2RDRD2HTR2AADRA2ASLC6A2
SCHEMBL6196165 0.89 UTS2R (0.58) UTS2RDRD2HTR2AADRA2ASLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1499607-B1 4-(PIPERIDYL- AND PYRROLIDYL-ALKYL-UREIDO)-QUINOLINES AS UROTENSIN II RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2005-12-07 EP disclosed