SCHEMBL13766701

SCHEMBL13766701

Cn1ncc(C(=O)NC2C3CC4CC(C3)CC2C4)c1O

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.64
HTT P42858 1/20 0.64
HSD11B1 P28845 13/20 0.54
ALDH1A1 P00352 2/20 0.51
HPGD P15428 2/20 0.51
SMN1; SMN2 Q16637 1/20 0.50
CNR2 P34972 1/20 0.46

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
SCHEMBL1406794 0.86 HTT (0.71) LMNAHTTHSD11B1ALDH1A1HPGD
SCHEMBL13767005 0.82 HSD11B1 (0.77) LMNAHTTHSD11B1ALDH1A1HPGD
SCHEMBL1406622 0.81 HSD11B1 (0.62) LMNAHTTHSD11B1ALDH1A1HPGD
SCHEMBL1406747 0.80 LMNA (0.57) LMNAHTTHSD11B1ALDH1A1HPGD
SCHEMBL2318195 0.80 LMNA (0.57) LMNAHTTHSD11B1ALDH1A1HPGD
SCHEMBL1406769 0.80 LMNA (0.57) LMNAHTTHSD11B1ALDH1A1HPGD
SCHEMBL17226577 0.80 HTT (0.43) LMNAHTTHSD11B1CNR2
SCHEMBL1407126 0.79 LMNA (0.56) LMNAHTTHSD11B1ALDH1A1HPGD
SCHEMBL1407046 0.79 LMNA (0.56) LMNAHTTHSD11B1ALDH1A1HPGD
SCHEMBL1406889 0.79 LMNA (0.56) LMNAHTTHSD11B1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8324265-B2 Heterocyclic compounds having type I 11β hydroxysteroid dehydrogenase inhibitory activity SHIONOGI & CO., LTD. (JP) 2012-12-04 US disclosed
US-8324265-B2 Heterocyclic compounds having type I 11β hydroxysteroid dehydrogenase inhibitory activity SHIONOGI & CO., LTD. (JP) 2012-12-04 US disclosed
US-20090170832-A1 HETEROCYCLIC COMPOUNDS HAVING TYPE I 11beta HYDROXYSTEROID DEHYDROGENASE INHIBITORY ACTIVITY SHIONOGI & CO., LTD. (JP) 2009-07-02 US disclosed
US-20090170832-A1 HETEROCYCLIC COMPOUNDS HAVING TYPE I 11beta HYDROXYSTEROID DEHYDROGENASE INHIBITORY ACTIVITY SHIONOGI & CO., LTD. (JP) 2009-07-02 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-20090170832-A1 HETEROCYCLIC COMPOUNDS HAVING TYPE I 11beta HYDROXYSTEROID DEHYDROGENASE INHIBITORY ACTIVITY HSD17B1, HSD11B1, HSD3B1 LMNA 2271/4885HTT 3719/4885HSD11B1 2/4885

“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.