SCHEMBL12895360

SCHEMBL12895360

CN1CCNC(=O)C12CCC(=O)CC2

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
OTUD7B Q6GQQ9 1/20 0.31

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
SCHEMBL12121672 0.88 OTUD7B (0.34) OTUD7B
SCHEMBL19329547 0.82 HSD17B10 (0.44) OTUD7B
SCHEMBL16901550 0.79 OTUD7B (0.30) OTUD7B
SCHEMBL12405036 0.77 CYP11B2 (0.36)
SCHEMBL15698055 0.77 CYP11B2 (0.36)
SCHEMBL15187449 0.75 GAA (0.33)
SCHEMBL15186145 0.75
SCHEMBL16750986 0.74 GRIN1 (0.36) OTUD7B
SCHEMBL16751010 0.74 GRIN1 (0.38) OTUD7B
SCHEMBL29889350 0.74 GAA (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
US-8629146-B2 Method for stereoselective synthesis of bicyclic heterocyclic compounds BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-01-14 US disclosed
US-20130211081-A1 METHOD FOR STEREOSELECTIVE SYNTHESIS OF BICYCLIC HETEROCYCLIC COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-08-15 US disclosed
WO-2011015526-A1 METHOD FOR STEREOSELECTIVE SYNTHESIS OF BICYCLIC HETEROCYCLIC COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-02-10 WO 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-20130211081-A1 METHOD FOR STEREOSELECTIVE SYNTHESIS OF BICYCLIC HETEROCYCLIC COMPOUNDS CYP3A5, CYP11B2, CYP11B1 OTUD7B 669/4885

“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.