SCHEMBL6199243

SCHEMBL6199243

Cc1cc(NC(=O)NCCN2CCC(NC(=O)Nc3ccccc3C)CC2)c2ccccc2n1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 4/20 0.62
SIGMAR1 Q99720 2/20 0.62
ADRA2A P08913 1/20 0.62
DRD2 P14416 1/20 0.62
SLC6A2 P23975 1/20 0.62
HTR2A P28223 1/20 0.62
HTR2C P28335 1/20 0.62
SLC6A4 P31645 1/20 0.62
TMEM97 Q5BJF2 1/20 0.62
KMT2A Q03164 3/20 0.58
MEN1 O00255 2/20 0.58
KDM4E B2RXH2 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
EPHX2 P34913 1/20 0.50

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
SCHEMBL6195501 0.95 UTS2R (0.58) UTS2RSIGMAR1ADRA2ADRD2SLC6A2
SCHEMBL6194052 0.91 UTS2R (0.60) UTS2RSIGMAR1ADRA2ADRD2SLC6A2
SCHEMBL6198361 0.91 UTS2R (0.66) UTS2RSIGMAR1ADRA2ADRD2SLC6A2
SCHEMBL4851886 0.91 UTS2R (0.59) UTS2RSIGMAR1ADRA2ADRD2SLC6A2
SCHEMBL6194772 0.90 UTS2R (0.63) UTS2RSIGMAR1ADRA2ADRD2SLC6A2
SCHEMBL6197130 0.90 UTS2R (0.65) UTS2RSIGMAR1ADRA2ADRD2SLC6A2
SCHEMBL6197361 0.90 UTS2R (0.61) UTS2RSIGMAR1ADRA2ADRD2SLC6A2
SCHEMBL4853350 0.90 UTS2R (0.58) UTS2RSIGMAR1ADRA2ADRD2SLC6A2
SCHEMBL6196070 0.90 UTS2R (0.58) UTS2RSIGMAR1ADRA2ADRD2SLC6A2
SCHEMBL6197447 0.90 UTS2R (0.60) UTS2RSIGMAR1ADRA2ADRD2SLC6A2

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