SCHEMBL6198352

SCHEMBL6198352

Cc1cc(NC(=O)NCCN2CCC(NC(=O)Nc3ccccc3F)C2)c2ccccc2n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 5/20 0.56
SIGMAR1 Q99720 2/20 0.56
ADRA2A P08913 1/20 0.56
DRD2 P14416 1/20 0.56
SLC6A2 P23975 1/20 0.56
HTR2A P28223 1/20 0.56
HTR2C P28335 1/20 0.56
SLC6A4 P31645 1/20 0.56
TMEM97 Q5BJF2 1/20 0.56
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
EPHX2 P34913 1/20 0.46
HTR1A P08908 1/20 0.45
HTR1D P28221 1/20 0.45
HTR1B P28222 1/20 0.45
KDM4E B2RXH2 1/20 0.45
CA12 O43570 2/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA4 P22748 2/20 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
SCHEMBL6194052 0.95 UTS2R (0.60) UTS2RSIGMAR1ADRA2ADRD2SLC6A2
SCHEMBL6199916 0.93 UTS2R (0.54) UTS2RSIGMAR1ADRA2ADRD2SLC6A2
SCHEMBL6195501 0.92 UTS2R (0.58) UTS2RSIGMAR1ADRA2ADRD2SLC6A2
SCHEMBL6195133 0.90 UTS2R (0.55) UTS2RSIGMAR1ADRA2ADRD2SLC6A2
SCHEMBL6195795 0.90 UTS2R (0.61) UTS2RSIGMAR1ADRA2ADRD2SLC6A2
SCHEMBL4852016 0.89 UTS2R (0.55) UTS2RSIGMAR1ADRA2ADRD2SLC6A2
SCHEMBL6197129 0.89 UTS2R (0.59) UTS2RSIGMAR1ADRA2ADRD2SLC6A2
SCHEMBL6198913 0.89 UTS2R (0.53) UTS2RSIGMAR1ADRA2ADRD2SLC6A2
SCHEMBL6198439 0.89 UTS2R (0.55) UTS2RSIGMAR1ADRA2ADRD2SLC6A2
SCHEMBL4860474 0.89 UTS2R (0.55) 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