SCHEMBL7604289

SCHEMBL7604289

O=C(O)c1ccccc1NCCCN1c2ccccc2CCc2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 3/20 0.55
HTR2A P28223 3/20 0.55
SLC6A4 P31645 3/20 0.55
CYP3A4 P08684 2/20 0.55
SLC22A2 O15244 2/20 0.55
SLC22A1 O15245 2/20 0.55
SLC22A3 O75751 2/20 0.55
CHRM2 P08172 2/20 0.55
CYP2D6 P10635 2/20 0.55
CHRM1 P11229 2/20 0.55
DRD2 P14416 2/20 0.55
ADRA2B P18089 2/20 0.55
ADRA2C P18825 2/20 0.55
CHRM3 P20309 2/20 0.55
HTR2C P28335 2/20 0.55
ADRA1A P35348 2/20 0.55
HRH1 P35367 2/20 0.55
DRD3 P35462 2/20 0.55
SCN1A P35498 2/20 0.55
OPRK1 P41145 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
SCHEMBL7609172 0.90 HDAC8 (0.61) SLC6A2HTR2ASLC6A4CYP3A4SLC22A2
SCHEMBL7808399 0.83 MAPK1 (0.51) SLC6A2HTR2ASLC6A4CYP3A4SLC22A2
SCHEMBL10130293 0.77 MEN1 (0.59) HTTSMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL7604317 0.77 CYP3A4 (0.51) SLC6A2HTR2ASLC6A4CYP3A4SLC22A2
SCHEMBL7810676 0.76 HDAC8 (0.55) SLC6A2HTR2ASLC6A4CYP3A4SLC22A2
SCHEMBL7603769 0.75 SLC6A2 (0.58) SLC6A2HTR2ASLC6A4CYP3A4SLC22A2
Hydrochloric Acid SCHEMBL7810034 0.74 SLC6A2 (0.59) SLC6A2HTR2ASLC6A4CYP3A4SLC22A2
SCHEMBL8689214 0.73 ALDH1A1 (0.79) MEN1KMT2AALDH1A1HPGDHSD17B10
SCHEMBL8025555 0.73 HTR2A (0.60) SLC6A2HTR2ASLC6A4CYP3A4SLC22A2
SCHEMBL1665592 0.73 ALDH1A1 (0.67) HTTKMT2AALDH1A1HPGDHSD17B10

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 12 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
EP-0820443-B1 HETEROCYCLIC COMPOUNDS FOR TREATING DIABETES NOVO NORDISK AS (DK) 2001-09-19 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
EP-0820443-A1 NOVEL HETEROCYCLIC COMPOUNDS NOVO NORDISK A/S (DK) 1998-01-28 EP claimed
WO-1996031481-A1 NOVEL HETEROCYCLIC COMPOUNDS NOVO NORDISK A/S (DK) 1996-10-10 WO claimed
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
EP-0820443-B1 HETEROCYCLIC COMPOUNDS FOR TREATING DIABETES NOVO NORDISK AS (DK) 2001-09-19 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-0820443-A1 NOVEL HETEROCYCLIC COMPOUNDS NOVO NORDISK A/S (DK) 1998-01-28 EP disclosed
WO-1996031481-A1 NOVEL HETEROCYCLIC COMPOUNDS NOVO NORDISK A/S (DK) 1996-10-10 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 (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-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 SLC6A2 2401/4885HTR2A 1379/4885SLC6A4 2949/4885

“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.