SCHEMBL442289

SCHEMBL442289

CCCN(CCN)CCO

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2D6 P10635 2/20 0.39
CYP2C19 P33261 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
LCK P06239 1/20 0.37
HSD17B10 Q99714 3/20 0.34
HIF1A Q16665 2/20 0.34
HPGD P15428 1/20 0.34
MAPK1 P28482 1/20 0.34
TSHR P16473 3/20 0.33
MAPT P10636 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HTR1A P08908 1/20 0.31
CA12 O43570 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
CYP3A4 P08684 1/20 0.31
DRD2 P14416 1/20 0.31
NFKB1 P19838 1/20 0.31

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
SCHEMBL18067187 0.98 CYP1A2 (0.38) CYP1A2CYP2C9CYP2D6CYP2C19NPSR1
SCHEMBL16660269 0.88 CYP1A2 (0.33) CYP1A2CYP2C9CYP2D6CYP2C19NPSR1
Trolamine SCHEMBL2489430 0.87 ALDH1A1 (0.39) CYP1A2CYP2C9CYP2D6CYP2C19NPSR1
Monoethanolamine SCHEMBL7890670 0.87 ALDH1A1 (0.47) CYP1A2CYP2C9CYP2D6CYP2C19NPSR1
SCHEMBL1273910 0.87 LCK (0.44) CYP2D6LCKHSD17B10HIF1ATSHR
SCHEMBL62953 0.87 ALDH1A1 (0.44) CYP1A2CYP2C9LCKHSD17B10HIF1A
SCHEMBL62067 0.87 ALDH1A1 (0.44) CYP1A2CYP2C9LCKHSD17B10HIF1A
SCHEMBL578516 0.87 LCK (0.44) CYP2D6LCKHSD17B10HIF1ATSHR
SCHEMBL97470 0.87 MAPT (0.42) CYP1A2CYP2C9CYP2D6CYP2C19NPSR1
SCHEMBL8990 0.87 MAPT (0.42) CYP1A2CYP2C9CYP2D6CYP2C19NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12016922-B2 Stabilized aqueous antibody compositions ARECOR LIMITED (GB) 2024-06-25 US disclosed
WO-2024110381-A1 IONIZABLE LIPIDS AND LIPID NANOPARTICLES CONTAINING THEREOF CERTEST BIOTEC, S.L. (ES) 2024-05-30 WO disclosed
US-11697804-B2 Transcriptionally targeted and CpG-free plasmid for theranostic gene therapy THE JOHNS HOPKINS UNIVERSITY (US) 2023-07-11 US disclosed
US-11524937-B2 Indirubin derivatives, and uses thereof CITY OF HOPE (US) 2022-12-13 US disclosed
EP-3412694-B1 AQUEOUS DISPERSION, METHOD FOR MANUFACTURING THE SAME, AND IMAGE FORMING METHOD FUJIFILM CORP (JP) 2021-12-08 EP disclosed
US-20200138946-A1 STABILIZED AQUEOUS ANTIBODY COMPOSITIONS ARECOR LIMITED (GB) 2020-05-07 US disclosed
WO-2019101853-A1 TREATMENT OF SKIN DISORDERS PIQUR THERAPEUTICS AG (CH) 2019-05-31 WO disclosed
US-20180134753-A1 BIOMIMETIC PEPTIDE AND BIODEGRADABLE DELIVERY PLATFORM FOR THE TREATMENT OF ANGIOGENESIS- AND LYMPHANGIOGENESIS-DEPENDENT DISEASES THE JOHNS HOPKINS UNIVERSITY 2018-05-17 US disclosed
US-20180028455-A1 PEPTIDE/PARTICLE DELIVERY SYSTEMS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2018-02-01 US disclosed
US-9802984-B2 Biomimetic peptide and biodegradable delivery platform for the treatment of angiogenesis- and lymphangiogenesis-dependent diseases THE JOHNS HOPKINS UNIVERSITY (US) 2017-10-31 US disclosed
US-20120065114-A1 AMINE REACTION COMPOUNDS COMPRISING ONE OR MORE ACTIVE INGREDIENT THE PROCTER & GAMBLE COMPANY (US) 2012-03-15 US disclosed
US-20110207643-A1 AMINE REACTION COMPOUNDS COMPRISING ONE OR MORE ACTIVE INGREDIENT THE PROCTER & GAMBLE COMPANY (US) 2011-08-25 US disclosed
US-20110082064-A1 AMINE REACTION COMPOUNDS COMPRISING ONE OR MORE ACTIVE INGREDIENT THE PROCTER & GAMBLE COMPANY (US) 2011-04-07 US disclosed
US-20100234258-A1 AMINE REACTION COMPOUNDS COMPRISING ONE OR MORE ACTIVE INGREDIENT THE PROCTER & GAMBLE COMPANY (US) 2010-09-16 US disclosed
US-20100041573-A1 AMINE REACTION COMPOUNDS COMPRISING ONE OR MORE ACTIVE INGREDIENT THE PROCTER & GAMBLE COMPANY (US) 2010-02-18 US disclosed
US-20090131294-A1 AMINE REACTION COMPOUNDS COMPRISING ONE OR MORE ACTIVE INGREDIENT BETTIOL JEAN-LUC PHILIPPE 2009-05-21 US disclosed
US-20080227676-A1 Amine reaction compounds comprising one or more active ingredient PROCTER & GAMBLE COMPANY, THE 2008-09-18 US disclosed
CN-101175558-A Dispersing agent NOVEON INC (US) 2008-05-07 CN disclosed
US-20070232507-A1 Amine reaction compounds comprising one or more active ingredient THE PROCTER & GAMBLE COMPANY ATTENTION: CHIEF PATENT COUNSEL (US) 2007-10-04 US disclosed
US-20070099818-A1 Amine reaction compounds comprising one or more active ingredient THE PROCTER & GAMBLE COMPANY (US) 2007-05-03 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 (9 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-11524937-B2 Indirubin derivatives, and uses thereof HCCS, ABL1, MAP3K7 CYP1A2 763/4885CYP2C9 1652/4885CYP2D6 1695/4885
US-20100041573-A1 AMINE REACTION COMPOUNDS COMPRISING ONE OR MORE ACTIVE INGREDIENT MAOA, MAOB, CMA1 CYP1A2 108/4885CYP2C9 140/4885CYP2D6 268/4885
US-20110082064-A1 AMINE REACTION COMPOUNDS COMPRISING ONE OR MORE ACTIVE INGREDIENT MAOA, MAOB, CMA1 CYP1A2 108/4885CYP2C9 140/4885CYP2D6 268/4885
US-20110207643-A1 AMINE REACTION COMPOUNDS COMPRISING ONE OR MORE ACTIVE INGREDIENT MAOA, MAOB, CMA1 CYP1A2 108/4885CYP2C9 140/4885CYP2D6 268/4885
US-20200138946-A1 STABILIZED AQUEOUS ANTIBODY COMPOSITIONS IGLV6-57, FCGRT, PA2G4 CYP1A2 4874/4885CYP2C9 4868/4885CYP2D6 4872/4885
US-20180134753-A1 BIOMIMETIC PEPTIDE AND BIODEGRADABLE DELIVERY PLATFORM FOR THE TREATMENT OF ANGIOGENESIS- AND LYMPHANGIOGENESIS-DEPENDENT DISEASES VEGFA, LRRFIP1, FLT1 CYP1A2 4874/4885CYP2C9 4814/4885CYP2D6 4719/4885
US-12016922-B2 Stabilized aqueous antibody compositions IGLV6-57, FCGRT, PA2G4 CYP1A2 4874/4885CYP2C9 4868/4885CYP2D6 4872/4885
US-11697804-B2 Transcriptionally targeted and CpG-free plasmid for theranostic gene therapy POLRMT, HDGF, PCNP CYP1A2 4505/4885CYP2C9 4548/4885CYP2D6 3886/4885
US-20180028455-A1 PEPTIDE/PARTICLE DELIVERY SYSTEMS VEGFA, IAPP, FLT1 CYP1A2 4850/4885CYP2C9 4719/4885CYP2D6 4732/4885

“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.