SCHEMBL18232155

SCHEMBL18232155

CC(OC(=O)COCC(=O)ON1C(=O)CCC1=O)C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA2B P29275 1/20 0.33
KMT2A Q03164 1/20 0.30
ATM Q13315 1/20 0.30

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
SCHEMBL2568708 0.82 ADORA3 (0.37) ADORA3ADORA2AADORA2B
SCHEMBL31121823 0.79 ADORA3 (0.34) ADORA3ADORA2AADORA2BKMT2AATM
SCHEMBL13624500 0.79 MMP1 (0.38) KMT2A
SCHEMBL26167886 0.78 KMT2A (0.34) ADORA3ADORA2AADORA2BKMT2AATM
SCHEMBL12922784 0.78 ADORA3 (0.31) ADORA3ADORA2AADORA2B
SCHEMBL16314439 0.78 ADORA3 (0.36) ADORA3ADORA2AADORA2B
SCHEMBL2607876 0.76 ADORA3 (0.37) ADORA3ADORA2AADORA2BKMT2A
SCHEMBL12743131 0.76 ADORA3 (0.33) ADORA3ADORA2AADORA2B
SCHEMBL13323678 0.76 ADORA3 (0.33) ADORA3ADORA2AADORA2B
SCHEMBL14644902 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230330273-A1 MAGNETIC NANOPARTICLES FUNCTIONALIZED WITH CATHECOL, PRODUCTION AND USE THEREOF COLOROBBIA ITALIA S.P.A. (IT) 2023-10-19 US disclosed
US-20160331850-A1 MAGNETIC NANOPARTICLES FUNCTIONALIZED WITH CATHECOL, PRODUCTION AND USE THEREOF COLOROBBIA ITALIA S.P.A. (IT) 2016-11-17 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 (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-20160331850-A1 MAGNETIC NANOPARTICLES FUNCTIONALIZED WITH CATHECOL, PRODUCTION AND USE THEREOF CD47, CD14, COMT ADORA3 2161/4885ADORA2A 3156/4885ADORA2B 4313/4885
US-20230330273-A1 MAGNETIC NANOPARTICLES FUNCTIONALIZED WITH CATHECOL, PRODUCTION AND USE THEREOF CD47, CD14, COMT ADORA3 2161/4885ADORA2A 3156/4885ADORA2B 4313/4885

“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.