SCHEMBL4851886

SCHEMBL4851886

Cc1cc(NC(=O)NCCN2CCC(NC(=O)Nc3ccccc3-c3ccccc3)CC2)c2ccccc2n1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 5/20 0.59
SIGMAR1 Q99720 2/20 0.59
ADRA2A P08913 2/20 0.59
DRD2 P14416 2/20 0.59
HTR2A P28223 2/20 0.59
SLC6A2 P23975 1/20 0.59
HTR2C P28335 1/20 0.59
SLC6A4 P31645 1/20 0.59
TMEM97 Q5BJF2 1/20 0.59
GAA P10253 1/20 0.50
KDM4E B2RXH2 1/20 0.50
TSHR P16473 2/20 0.49
MAPK1 P28482 1/20 0.49
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
HTR1A P08908 1/20 0.44
DRD1 P21728 1/20 0.44
DRD4 P21917 1/20 0.44
DRD5 P21918 1/20 0.44
ADRA1A P35348 1/20 0.44

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
SCHEMBL4852016 0.95 UTS2R (0.55) UTS2RSIGMAR1ADRA2ADRD2HTR2A
SCHEMBL6199243 0.91 UTS2R (0.62) UTS2RSIGMAR1ADRA2ADRD2HTR2A
SCHEMBL6194052 0.89 UTS2R (0.60) UTS2RSIGMAR1ADRA2ADRD2HTR2A
SCHEMBL6198361 0.89 UTS2R (0.66) UTS2RSIGMAR1ADRA2ADRD2HTR2A
SCHEMBL6194772 0.88 UTS2R (0.63) UTS2RSIGMAR1ADRA2ADRD2HTR2A
SCHEMBL6197130 0.88 UTS2R (0.65) UTS2RSIGMAR1ADRA2ADRD2HTR2A
SCHEMBL4853350 0.87 UTS2R (0.58) UTS2RSIGMAR1ADRA2ADRD2HTR2A
SCHEMBL6196070 0.87 UTS2R (0.58) UTS2RSIGMAR1ADRA2ADRD2HTR2A
SCHEMBL6197447 0.87 UTS2R (0.60) UTS2RSIGMAR1ADRA2ADRD2HTR2A
SCHEMBL6196877 0.87 UTS2R (0.69) UTS2RSIGMAR1ADRA2ADRD2HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7375227-B2 Quinoline derivatives ACTELION PHARMACEUTICALS LTD. (CH) 2008-05-20 US claimed
EP-1499607-B1 4-(PIPERIDYL- AND PYRROLIDYL-ALKYL-UREIDO)-QUINOLINES AS UROTENSIN II RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2005-12-07 EP claimed
US-20050043535-A1 4-(Piperidyl-and pyrrolidyl-alkyl-ureido)-quinolines as urotensin II receptor antagonists ACTELION PHARMACEUTICALS LTD. (CH) 2005-02-24 US claimed
EP-1499607-A1 4-(PIPERIDYL- AND PYRROLIDYL-ALKYL-UREIDO)-QUINOLINES AS UROTENSIN II RECEPTOR ANTAGONISTS Actelion Pharmaceuticals Ltd. (CH) 2005-01-26 EP claimed
WO-2003048154-A1 4-(PIPERIDYL- AND PYRROLIDYL-ALKYL-UREIDO) -QUINOLINES AS UROTENSIN II RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2003-06-12 WO claimed
US-7375227-B2 Quinoline derivatives ACTELION PHARMACEUTICALS LTD. (CH) 2008-05-20 US disclosed
EP-1499607-B1 4-(PIPERIDYL- AND PYRROLIDYL-ALKYL-UREIDO)-QUINOLINES AS UROTENSIN II RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2005-12-07 EP disclosed
US-20050043535-A1 4-(Piperidyl-and pyrrolidyl-alkyl-ureido)-quinolines as urotensin II receptor antagonists ACTELION PHARMACEUTICALS LTD. (CH) 2005-02-24 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050043535-A1 4-(Piperidyl-and pyrrolidyl-alkyl-ureido)-quinolines as urotensin II receptor antagonists UTS2R, NTSR2, PLAUR UTS2R 1/4885SIGMAR1 317/4885ADRA2A 58/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.