SCHEMBL3602294

SCHEMBL3602294

C1=NCCN1.COC(=O)c1c[nH]cn1

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.36
PLAT P00750 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
SCHEMBL69204 0.83
4-Imidazolecarboxylic Acid SCHEMBL13733596 0.77 KDM4E (0.45) MAPK1
Biphenyl SCHEMBL27647991 0.73 AXL (0.48) MAPK1
Trifluoroacetic Acid SCHEMBL30271697 0.73 MAPK1 (0.40) MAPK1
SCHEMBL5572213 0.72 GABRP (0.34)
SCHEMBL13733597 0.70 MAPK1 (0.37) MAPK1
Acetone SCHEMBL29183514 0.68 GABRP (0.34)
Acetone SCHEMBL28453050 0.68
SCHEMBL3189182 0.68 KDM4E (0.40) MAPK1
Ethaneperoxoic Acid SCHEMBL31288599 0.67 GABRP (0.31)

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-7728028-B2 Substituted imidazoline compounds GRUENENTHAL GMBH (DE) 2010-06-01 US disclosed
US-20090048323-A1 SUBSTITUTED IMIDAZOLINE COMPOUNDS GRUENENTHAL GMBH (DE) 2009-02-19 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-20090048323-A1 SUBSTITUTED IMIDAZOLINE COMPOUNDS ITCH, OPRK1, ALDH1A1 MAPK1 1120/4885PLAT 3843/4885

“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.