SCHEMBL1763389

SCHEMBL1763389

CC[C@H]1CC[C@H](CC)N1C=O

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
MAPK1 P28482 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL1762949 1.00 ALDH1A1 (0.33) ALDH1A1MAPK1TDP1
SCHEMBL1762947 1.00 ALDH1A1 (0.33) ALDH1A1MAPK1TDP1
SCHEMBL22048285 0.78
SCHEMBL4150294 0.73
SCHEMBL19539825 0.69
SCHEMBL13354236 0.67 ALDH1A1 (0.33) ALDH1A1MAPK1TDP1
SCHEMBL6506120 0.67
SCHEMBL12311430 0.67
SCHEMBL23263135 0.66 ALDH1A1 (0.32) ALDH1A1MAPK1TDP1
SCHEMBL4158148 0.66 KMT2A (0.41) ALDH1A1

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-8759541-B2 Chiral acyclic diaminocarbene ligands, precursors therefore and their use in organic synthesis reactions THADANI AVINASH N (CA) 2014-06-24 US disclosed
US-20110118475-A1 CHIRAL ACYCLIC DIAMINOCARBENE LIGANDS, PRECURSORS THEREFORE AND THEIR USE IN ORGANIC SYNTHESIS REACTIONS THADANI AVINASH N 2011-05-19 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-20110118475-A1 CHIRAL ACYCLIC DIAMINOCARBENE LIGANDS, PRECURSORS THEREFORE AND THEIR USE IN ORGANIC SYNTHESIS REACTIONS AOC1, ODC1, AMD1 ALDH1A1 428/4885MAPK1 1165/4885TDP1 4672/4885

“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.