SCHEMBL30827

SCHEMBL30827

CC(COC(=O)c1cccc(C(=O)Cl)c1)OC(=O)c1cccc(C(=O)Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 8/20 0.44
ADRB1 P08588 8/20 0.44
ADRB3 P13945 8/20 0.44
PTPN1 P18031 1/20 0.43
ALDH1A1 P00352 2/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
TSHR P16473 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
JMJD6 Q6NYC1 1/20 0.40

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
SCHEMBL10575617 0.87 MAPT (0.48) ADRB2ADRB1ADRB3PTPN1ALDH1A1
SCHEMBL1786925 0.85 CHRM2 (0.51) ADRB2ADRB1ADRB3PTPN1ALDH1A1
SCHEMBL31734114 0.84 ATM (0.51) ADRB2ADRB1ADRB3ALDH1A1MAPT
SCHEMBL23484189 0.84 ADRB2 (0.56) ADRB2ADRB1ADRB3PTPN1ALDH1A1
SCHEMBL16759945 0.83 MAPT (0.55) ADRB2ADRB1ADRB3PTPN1ALDH1A1
SCHEMBL13789083 0.82 ADRB2 (0.51) ADRB2ADRB1ADRB3PTPN1ALDH1A1
SCHEMBL227395 0.81 ALDH1A1 (0.62) ADRB2ADRB1ADRB3ALDH1A1MAPT
SCHEMBL16019900 0.81 ALDH1A1 (0.62) ADRB2ADRB1ADRB3ALDH1A1MAPT
SCHEMBL109308 0.81 ALDH1A1 (0.61) ADRB2ADRB1ADRB3ALDH1A1TSHR
SCHEMBL16217637 0.80 ALDH1A1 (0.61) ADRB2ADRB1ADRB3ALDH1A1MAPT

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8507612-B2 Aziridine crosslinking agents for acrylic adhesives 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-08-13 US disclosed
EP-2406338-B1 AZIRIDINE CROSSLINKING AGENTS FOR ACRYLIC ADHESIVES 3M INNOVATIVE PROPERTIES CO (US) 2012-11-28 EP disclosed
EP-2406338-A1 AZIRIDINE CROSSLINKING AGENTS FOR ACRYLIC ADHESIVES 3M Innovative Properties Company (US) 2012-01-18 EP disclosed
WO-2010104645-A1 AZIRIDINE CROSSLINKING AGENTS FOR ACRYLIC ADHESIVES 3M INNOVATIVE PROPERTIES COMPANY (US) 2010-09-16 WO disclosed
US-20100227969-A1 AZIRIDINE CROSSLINKING AGENTS FOR ACRYLIC ADHESIVES 3M INNOVATIVE PROPERTIES COMPANY 2010-09-09 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 (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-20100227969-A1 AZIRIDINE CROSSLINKING AGENTS FOR ACRYLIC ADHESIVES AAAS, ADGRF1, CDH1 ADRB2 2417/4885ADRB1 2105/4885ADRB3 2946/4885

“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.