SCHEMBL1077227

SCHEMBL1077227

C=CCN1C(=O)NCC1N

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.35
MAPT P10636 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
POLB P06746 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
SCHEMBL4543295 0.77 CYP3A4 (0.35) CYP3A4MAPTL3MBTL1POLB
SCHEMBL4595333 0.76 CYP3A4 (0.34) CYP3A4MAPTL3MBTL1POLB
SCHEMBL14629851 0.74
SCHEMBL16685520 0.69
SCHEMBL8005927 0.68
Hydrochloric Acid SCHEMBL8927737 0.66 KDM4E (0.35)
SCHEMBL16139578 0.65 P2RX7 (0.32) L3MBTL1
SCHEMBL18106821 0.64 CYP3A4 (0.42) CYP3A4MAPTL3MBTL1POLB
SCHEMBL8892656 0.64
SCHEMBL669955 0.63 ALDH1A1 (0.34) CYP3A4MAPTL3MBTL1

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
WO-1995000598-A1 METHOD FOR PRODUCING A STRUCTURAL ADHESIVE AND METHOD FOR ASSEMBLING SAME CRAY VALLEY S.A. (FR) 1995-01-05 WO claimed
EP-2217641-B1 MATERIAL FORMED FROM DENDRITIC MOLECULES CONTAINING ASSOCIATIVE GROUPS ARKEMA FRANCE (FR) 2017-03-08 EP disclosed
US-9301912-B2 Material formed from dendritic molecules containing associative groups ARKEMA FRANCE (FR) 2016-04-05 US disclosed
US-20150132239-A1 MATERIAL FORMED FROM DENDRITIC MOLECULES CONTAINING ASSOCIATIVE GROUPS CENTRE NATIONAL DE LA RECHERCHE SCIENTIGIQUE CNRS (FR) 2015-05-14 US disclosed
US-20110003872-A1 MATERIAL FORMED FROM DENDRITIC MOLECULES CONTAINING ASSOCIATIVE GROUPS ARKEMA FRANCE (FR) 2011-01-06 US disclosed
EP-2217641-A1 MATERIAL FORMED FROM DENDRITIC MOLECULES CONTAINING ASSOCIATIVE GROUPS ARKEMA FRANCE (FR) 2010-08-18 EP disclosed
WO-2009071554-A1 MATERIAL FORMED FROM DENDRITIC MOLECULES CONTAINING ASSOCIATIVE GROUPS ARKEMA FRANCE (FR) 2009-06-11 WO disclosed
WO-1995000598-A1 METHOD FOR PRODUCING A STRUCTURAL ADHESIVE AND METHOD FOR ASSEMBLING SAME CRAY VALLEY S.A. (FR) 1995-01-05 WO disclosed
EP-0614481-A1 SYSTEMS FOR CROSS-LINKABLE HOT-MELT ADHESIVES, THEIR PREPARATION METHOD AND AN ASSEMBLY METHOD USING SAME BOSTIK GMBH (DE) 1994-09-14 EP disclosed
WO-1993011200-A1 SYSTEMS FOR CROSS-LINKABLE HOT-MELT ADHESIVES, THEIR PREPARATION METHOD AND AN ASSEMBLY METHOD USING SAME BOSTIK SA (FR) 1993-06-10 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 (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-20110003872-A1 MATERIAL FORMED FROM DENDRITIC MOLECULES CONTAINING ASSOCIATIVE GROUPS HLA-DRB1, CD14, CD74 CYP3A4 4878/4885MAPT 595/4885L3MBTL1 4429/4885
US-20150132239-A1 MATERIAL FORMED FROM DENDRITIC MOLECULES CONTAINING ASSOCIATIVE GROUPS HLA-DRB1, CD14, CD74 CYP3A4 4878/4885MAPT 588/4885L3MBTL1 4423/4885

“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.