SCHEMBL4470930

SCHEMBL4470930

CN(C)CCN(C=O)c1cc[c]cc1

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.32

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
SCHEMBL5105795 0.85 ALOX15 (0.33) ALOX15
SCHEMBL149576 0.80 ALDH1A1 (0.38)
SCHEMBL4489884 0.79
SCHEMBL2038948 0.79 ALOX15 (0.42) ALOX15
SCHEMBL4489489 0.79 NLRP3 (0.31) ALOX15
SCHEMBL6320611 0.78 ALDH1A1 (0.44) ALOX15
SCHEMBL4473097 0.75 HDAC2 (0.34)
SCHEMBL4487670 0.75 HTR1A (0.36)
SCHEMBL523503 0.74 HRH3 (0.36)
SCHEMBL11331244 0.73 ALDH1A1 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102803474-A Beta-cell replication promoting compounds and methods of their use HARVARD COLLEGE 2012-11-28 CN disclosed
US-7511065-B2 Mixed lineage kinase modulators ELI LILLY AND COMPANY (US) 2009-03-31 US disclosed
US-20080113977-A1 Mixed Lineage Kinase Modulators ELI LILLY AND COMPANY 2008-05-15 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-20080113977-A1 Mixed Lineage Kinase Modulators MYLK2, CSNK1G2, CSNK1A1 ALOX15 4350/4885

“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.