SCHEMBL13767276

SCHEMBL13767276

CN1CCC(NCCn2ncc(C(=O)NC3C4CC5CC(C4)CC3C5)c2OCC2CCCCC2)CC1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GUCY1B2 O75343 2/20 0.41
GUCY1A2 P33402 2/20 0.41
GUCY1A1 Q02108 2/20 0.41
GUCY1B1 Q02153 2/20 0.41
HSD11B1 P28845 12/20 0.41
HTT P42858 1/20 0.39
LMNA P02545 1/20 0.39
PTK2 Q05397 1/20 0.37
CNR2 P34972 1/20 0.36

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
SCHEMBL13766940 0.94 HSD11B1 (0.41) HSD11B1HTTLMNACNR2
SCHEMBL13766941 0.94 HSD11B1 (0.41) HSD11B1HTTLMNACNR2
SCHEMBL13766973 0.90 HSD11B1 (0.39) HSD11B1HTTLMNACNR2
SCHEMBL13766771 0.89 LMNA (0.43) LMNA
SCHEMBL13767273 0.88 HSD11B1 (0.43) HSD11B1HTTLMNACNR2
SCHEMBL13767260 0.88 HSD11B1 (0.41) HSD11B1HTTLMNACNR2
SCHEMBL13766955 0.88 HSD11B1 (0.44) HSD11B1HTTLMNACNR2
SCHEMBL13766988 0.87 HSD11B1 (0.42) HSD11B1HTTLMNACNR2
SCHEMBL13766993 0.87 HSD11B1 (0.38) HSD11B1HTTLMNACNR2
SCHEMBL13767082 0.86 HSD11B1 (0.54) HSD11B1

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-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

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 GUCY1B2 1262/4885GUCY1A2 1436/4885GUCY1A1 1207/4885

“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.