SCHEMBL1872471

SCHEMBL1872471

CC(N)COCCOCCOCCCN

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.46
ODC1 P11926 1/20 0.35
HTT P42858 1/20 0.34
ALDH1A1 P00352 1/20 0.33
TLR2 O60603 2/20 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
SCHEMBL21071668 0.95 CYP3A4 (0.46) CYP3A4ODC1HTTALDH1A1TLR2
SCHEMBL9291335 0.86 ALDH1A1 (0.36) CYP3A4ALDH1A1
SCHEMBL12695269 0.85 ALDH1A1 (0.37) CYP3A4ALDH1A1
SCHEMBL12269417 0.85 ALDH1A1 (0.37) CYP3A4ALDH1A1
Water SCHEMBL28694307 0.83 ALDH1A1 (0.35) CYP3A4ALDH1A1
SCHEMBL9392642 0.83 HTT (0.40) CYP3A4HTTALDH1A1
SCHEMBL194541 0.83 ALDH1A1 (0.39) CYP3A4ALDH1A1
SCHEMBL28689011 0.80 CYP3A4 (0.33) CYP3A4TLR2
SCHEMBL825247 0.80
SCHEMBL31360426 0.80 CA2 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190192398-A1 Hair Strengthening Ingredient And Hair-Strengthening Method IP FULL ASSET LIMITED (CN) 2019-06-27 US claimed
EP-2002850-B1 Adhesive formulations COVIDIEN LP (US) 2017-04-05 EP claimed
EP-2002850-A2 Adhesive formulations Tyco Healthcare Group, LP (US) 2008-12-17 EP claimed
EP-1960446-A2 BIOCOMPATIBLE SURGICAL COMPOSITIONS Tyco Healthcare Group, LP (US) 2008-08-27 EP claimed
US-20070135606-A1 Biocompatible surgical compositions TYCO HEALTHCARE GROUP LP 2007-06-14 US claimed
WO-2007067764-A2 BIOCOMPATIBLE SURGICAL COMPOSITIONS TYCO HEALTHCARE GROUP LP (US) 2007-06-14 WO claimed
EP-2002850-B1 Adhesive formulations COVIDIEN LP (US) 2017-04-05 EP disclosed
EP-1962867-B1 BIOCOMPATIBLE SURGICAL COMPOSITIONS COVIDIEN LP (US) 2013-06-19 EP disclosed
US-7998466-B2 Biocompatible tissue sealants and adhesives TYCO HEALTHCARE GROUP LP (US) 2011-08-16 US disclosed
US-7947263-B2 Biocompatible surgical compositions TYCO HEALTHCARE GROUP LP (US) 2011-05-24 US disclosed
EP-2002850-A2 Adhesive formulations Tyco Healthcare Group, LP (US) 2008-12-17 EP disclosed
EP-1962867-A2 BIOCOMPATIBLE SURGICAL COMPOSITIONS Tyco Healthcare Group, LP (US) 2008-09-03 EP disclosed
WO-2007067621-A2 BIOCOMPATIBLE SURGICAL COMPOSITIONS TYCO HEALTHCARE GROUP LP (US) 2007-06-14 WO disclosed
US-20070128153-A1 Biocompatible surgical compositions TYCO HEALTHCARE GROUP LP 2007-06-07 US disclosed
US-20070128152-A1 Biocompatible tissue sealants and adhesives TYCO HEALTHCARE GROUP LP 2007-06-07 US disclosed
WO-2001040396-A2 URETHANE MODIFIED EPOXY ADHESIVE COMPOSITION REICHHOLD, INC. (US) 2001-06-07 WO disclosed
EP-0820492-B1 EPOXY ADHESIVES WITH DITHIOOXAMIDE ADHESION PROMOTERS MINNESOTA MINING & MFG (US) 1999-08-25 EP disclosed
US-5712039-A AMINE CURED EPOXY ADHESIVES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1998-01-27 US disclosed
EP-0726928-A1 ANTICORROSION ADHESIVE COMPOSITION AND METHOD MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-08-21 EP disclosed
WO-1995012647-A1 ANTICORROSION ADHESIVE COMPOSITION AND METHOD MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-05-11 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-20070128152-A1 Biocompatible tissue sealants and adhesives CDH1, EPCAM, DSP CYP3A4 4432/4885ODC1 2745/4885HTT 4294/4885
US-20190192398-A1 Hair Strengthening Ingredient And Hair-Strengthening Method KRT18, PHB1, PHB2 CYP3A4 4506/4885ODC1 1125/4885HTT 661/4885

“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.