SCHEMBL2676995

SCHEMBL2676995

NCCCc1ccccc1Oc1ccccc1

nearest known ligand 0.79

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 1/20 0.79
SLC6A4 P31645 2/20 0.51
RIPK1 Q13546 1/20 0.51
SLC6A2 P23975 1/20 0.51
TAAR1 Q96RJ0 1/20 0.47
DPP4 P27487 1/20 0.46
CYP19A1 P11511 1/20 0.43
LTA4H P09960 1/20 0.43
PLA2G2A P14555 1/20 0.43
FFAR1 O14842 1/20 0.42
MAOA P21397 1/20 0.42
ADRA2C P18825 1/20 0.41
CTNNB1 P35222 1/20 0.41
HTR2A P28223 1/20 0.41

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
Phosphine SCHEMBL29079498 0.98 HRH1 (0.77) HRH1SLC6A4RIPK1SLC6A2TAAR1
SCHEMBL1569927 0.89 HRH1 (1.00) HRH1SLC6A4RIPK1SLC6A2TAAR1
Hydrochloric Acid SCHEMBL6963688 0.87 HRH1 (0.96) HRH1SLC6A4RIPK1SLC6A2TAAR1
SCHEMBL5105918 0.85 HRH1 (0.68) HRH1SLC6A4RIPK1SLC6A2TAAR1
SCHEMBL8423083 0.82 HRH1 (0.55) HRH1SLC6A4SLC6A2TAAR1HTR2A
SCHEMBL6503487 0.81 HRH1 (0.62) HRH1SLC6A4RIPK1SLC6A2CYP19A1
SCHEMBL1070099 0.81 HRH1 (0.62) HRH1SLC6A4RIPK1SLC6A2CYP19A1
SCHEMBL7646958 0.81 HRH1 (0.62) HRH1SLC6A4RIPK1SLC6A2CYP19A1
SCHEMBL29580562 0.81 HRH1 (0.62) HRH1SLC6A4RIPK1SLC6A2LTA4H
SCHEMBL5389689 0.81 HRH1 (0.62) HRH1SLC6A4RIPK1SLC6A2DPP4

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9770442-B2 Self-assembling amphiphilic polymers as anti-cancer agents ALLEXCEL INC. (US) 2017-09-26 US disclosed
EP-2167103-B1 SELF-ASSEMBLING AMPHIPHILIC POLYMERS AS ANTICANCER AGENTS ALLEXCEL INC (US) 2017-03-01 EP disclosed
EP-2120974-B1 SELF-ASSEMBLING AMPHIPHILIC POLYMERS AS ANTIVIRAL AGENTS ALLEXCEL INC (US) 2017-03-01 EP disclosed
EP-1979407-B1 SOLUBILIZATION AND TARGETED DELIVERY OF DRUGS WITH SELF-ASSEMBLING AMPHIPHILIC POLYMERS ALLEXCEL INC (US) 2014-08-06 EP disclosed
US-8173764-B2 Solubilization and targeted delivery of drugs with self-assembling amphiphilic polymers ALLEXCEL INC. (US) 2012-05-08 US disclosed
US-20100260743-A1 Solubilization and Targeted Delivery of Drugs With Self-Assembling Amphiphilic Polymers ALLEXCEL, INC. (US) 2010-10-14 US disclosed
US-20100239659-A1 SELF-ASSEMBLING AMPHIPHILIC POLYMERS AS ANTI-CANCER AGENTS ALLEXCEL., INC. (US) 2010-09-23 US disclosed
EP-2167103-A1 SELF-ASSEMBLING AMPHIPHILIC POLYMERS AS ANTICANCER AGENTS Allexcel, Inc. (US) 2010-03-31 EP disclosed
US-20100008938-A1 SELF ASSEMBLING AMPHIPHILIC POLYMERS AS ANTIVIRAL AGENTS ALLEXCEL, INC. 2010-01-14 US disclosed
EP-2120974-A1 SELF-ASSEMBLING AMPHIPHILIC POLYMERS AS ANTIVIRAL AGENTS Allexcel, Inc. (US) 2009-11-25 EP disclosed
EP-1458368-B1 USE OF NOREPINEPHRINE REUPTAKE INHIBITORS FOR THE TREATMENT OF COGNITIVE FAILURE LILLY CO ELI (US) 2007-11-21 EP disclosed
WO-2007084126-A1 SOLUBILIZATION AND TARGETED DELIVERY OF DRUGS WITH SELF-ASSEMBLING AMPHIPHILIC POLYMERS ALLEXCEL, INC. (US) 2007-07-26 WO disclosed
CN-1713900-A Use of norepinephrine reuptake inhibitors for the treatment of cognitive disorders LILLY CO ELI (US) 2005-12-28 CN disclosed
US-20050009925-A1 Use of norepinephrine reuptake inhibitors for the treatment of cognitive failure BYMASTER FRANKLIN PORTER (US) 2005-01-13 US disclosed
EP-1458368-A1 USE OF NOREPINEPHRINE REUPTAKE INHIBITORS FOR THE TREATMENT OF COGNITIVE FAILURE ELI LILLY AND COMPANY (US) 2004-09-22 EP disclosed
WO-2003049724-A1 USE OF NOREPINEPHRINE REUPTAKE INHIBITORS FOR THE TREATMENT OF COGNITIVE FAILURE ELI LILLY AND COMPANY (US) 2003-06-19 WO disclosed
EP-0545425-B1 2-(3-Phenylpropyl)hydrazines, intermediates in and a process for the preparation thereof, and their use as medicaments HOECHST ROUSSEL PHARMA (US) 1996-03-20 EP disclosed
US-5268468-A Or optical isomers thereof HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1993-12-07 US disclosed
US-5229417-A Obsessive compulsive disorders HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1993-07-20 US disclosed
EP-0545425-A1 2-(3-Phenylpropyl)hydrazines, intermediates in and a process for the preparation thereof, and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1993-06-09 EP 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 (4 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-20050009925-A1 Use of norepinephrine reuptake inhibitors for the treatment of cognitive failure SLC6A2, PNMT, SLC6A3 HRH1 2171/4885SLC6A4 4/4885RIPK1 4409/4885
US-20100008938-A1 SELF ASSEMBLING AMPHIPHILIC POLYMERS AS ANTIVIRAL AGENTS PICALM, CLTA, HAVCR2 HRH1 2520/4885SLC6A4 3464/4885RIPK1 1611/4885
US-20100239659-A1 SELF-ASSEMBLING AMPHIPHILIC POLYMERS AS ANTI-CANCER AGENTS CD44, EPCAM, EGFR HRH1 1405/4885SLC6A4 3266/4885RIPK1 2726/4885
US-20100260743-A1 Solubilization and Targeted Delivery of Drugs With Self-Assembling Amphiphilic Polymers CD44, ABCG2, ABCC1 HRH1 1533/4885SLC6A4 826/4885RIPK1 3190/4885

“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.