SCHEMBL5495263

SCHEMBL5495263

O=C(O)C1CCN(CCCCN2c3ccccc3CCc3ccc(Cl)cc32)CC1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.55
DRD3 P35462 5/20 0.55
CHRM5 P08912 2/20 0.55
ADRA2A P08913 2/20 0.55
CYP2D6 P10635 2/20 0.55
ADRA2B P18089 2/20 0.55
ADRA2C P18825 2/20 0.55
DRD1 P21728 2/20 0.55
SLC6A2 P23975 2/20 0.55
ADRA1D P25100 2/20 0.55
HTR2A P28223 2/20 0.55
HTR2C P28335 2/20 0.55
SLC6A4 P31645 2/20 0.55
HRH1 P35367 2/20 0.55
HTR2B P41595 2/20 0.55
HTR6 P50406 2/20 0.55
SIGMAR1 Q99720 2/20 0.55
MEN1 O00255 2/20 0.55
TP53 P04637 2/20 0.55
CYP3A4 P08684 2/20 0.55

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
Hydrochloric Acid SCHEMBL7167859 0.99 MEN1 (0.55) DRD2DRD3CHRM5ADRA2ACYP2D6
SCHEMBL5494495 0.98 DRD2 (0.57) DRD2DRD3CHRM5ADRA2ACYP2D6
Hydrochloric Acid SCHEMBL6963930 0.97 DRD2 (0.56) DRD2DRD3CHRM5ADRA2ACYP2D6
SCHEMBL5500236 0.92 DRD2 (0.54) DRD2DRD3CHRM5ADRA2ACYP2D6
Hydrochloric Acid SCHEMBL6969742 0.91 DRD2 (0.53) DRD2DRD3CHRM5ADRA2ACYP2D6
SCHEMBL5494740 0.90 SLC6A1 (0.60) DRD2DRD3CHRM5ADRA1DADRB2
Hydrochloric Acid SCHEMBL7166172 0.89 SLC6A1 (0.58) DRD2DRD3CHRM5ADRA1DADRB2
SCHEMBL5500223 0.88 CHRM1 (0.61) DRD2DRD3CHRM5ADRA1DHRH1
Hydrochloric Acid SCHEMBL6962296 0.86 CHRM1 (0.60) DRD2DRD3CHRM5ADRA1DADRB2
SCHEMBL7168047 0.86 KMT2A (0.52) DRD2DRD3CHRM5ADRA2ACYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020045610-A1 Use of N-substituted azaheterocyclic compounds for the manufacture of a pharmaceutical composition for the treatment of indications related to angiogenesis LUBRIZOL CORPORATION, THE 2002-04-18 US claimed
EP-1135129-A1 USE OF N-SUBSTITUTED AZAHETEROCYCLIC COMPOUNDS FOR THE MANUFACTURE OF A PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF INDICATIONS RELATED TO ANGIOGENESIS NOVO NORDISK A/S (DK) 2001-09-26 EP claimed
WO-2000032193-A1 USE OF N-SUBSTITUTED AZAHETEROCYCLIC COMPOUNDS FOR THE MANUFACTURE OF A PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF INDICATIONS RELATED TO ANGIOGENESIS NOVO NORDISK A/S (DK) 2000-06-08 WO claimed
US-20070066570-A1 Methods for treating sleep disorders HYPNION, INC. 2007-03-22 US disclosed
US-6569849-B1 N-Substituted azaheterocyclic compounds NOVO NORDISK A/S (DK) 2003-05-27 US disclosed
US-20020045610-A1 Use of N-substituted azaheterocyclic compounds for the manufacture of a pharmaceutical composition for the treatment of indications related to angiogenesis LUBRIZOL CORPORATION, THE 2002-04-18 US disclosed
EP-1135129-A1 USE OF N-SUBSTITUTED AZAHETEROCYCLIC COMPOUNDS FOR THE MANUFACTURE OF A PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF INDICATIONS RELATED TO ANGIOGENESIS NOVO NORDISK A/S (DK) 2001-09-26 EP disclosed
WO-2000032193-A1 USE OF N-SUBSTITUTED AZAHETEROCYCLIC COMPOUNDS FOR THE MANUFACTURE OF A PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF INDICATIONS RELATED TO ANGIOGENESIS NOVO NORDISK A/S (DK) 2000-06-08 WO disclosed
EP-0934306-A1 N-SUBSTITUTED AZAHETEROCYCLIC COMPOUNDS NOVO NORDISK A/S (DK) 1999-08-11 EP disclosed
WO-1998015546-A1 N-SUBSTITUTED AZAHETEROCYCLIC COMPOUNDS NOVO NORDISK A/S (DK) 1998-04-16 WO 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 (2 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-20070066570-A1 Methods for treating sleep disorders HCRTR2, HNMT, HCRTR1 DRD2 366/4885DRD3 588/4885CHRM5 194/4885
US-20020045610-A1 Use of N-substituted azaheterocyclic compounds for the manufacture of a pharmaceutical composition for the treatment of indications related to angiogenesis VEGFA, KDR, FLT4 DRD2 2668/4885DRD3 3633/4885CHRM5 3834/4885

“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.