SCHEMBL5104769

SCHEMBL5104769

CC12CC3(C)CC(C)(C1)CC(c1nnc4n1CCCCC4)(C2)C3

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 18/20 0.59
HSD17B1 P14061 1/20 0.59
HSD11B2 P80365 10/20 0.52
POLB P06746 1/20 0.50

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
SCHEMBL14277201 0.86 HSD11B1 (0.66) HSD11B1HSD17B1HSD11B2POLB
SCHEMBL14277197 0.86 HSD11B1 (0.66) HSD11B1HSD17B1HSD11B2POLB
SCHEMBL14277194 0.86 HSD11B1 (0.66) HSD11B1HSD17B1HSD11B2POLB
SCHEMBL14277193 0.84 HSD11B1 (0.63) HSD11B1HSD17B1HSD11B2POLB
SCHEMBL14382298 0.82 HSD11B1 (0.72) HSD11B1HSD17B1HSD11B2POLB
SCHEMBL5253884 0.79 HSD11B1 (0.57) HSD11B1HSD17B1HSD11B2POLB
Trifluoroacetic Acid SCHEMBL5098023 0.76 HSD11B1 (0.53) HSD11B1HSD17B1HSD11B2
Trifluoroacetic Acid SCHEMBL5095893 0.76 HSD11B1 (0.53) HSD11B1HSD17B1HSD11B2
Trifluoroacetic Acid SCHEMBL5104740 0.76 HSD11B1 (0.53) HSD11B1HSD17B1HSD11B2
SCHEMBL5095978 0.74 HSD11B1 (1.00) HSD11B1HSD17B1HSD11B2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1474139-B1 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 INHIBITORS USEFUL FOR THE TREATMENT OF DIABETES, OBESITY AND DYSLIPIDEMIA MERCK & CO INC (US) 2007-11-21 EP claimed
US-7329683-B2 11-β-hydroxysteroid dehydrogenase 1 inhibitors useful for the treatment of diabetes, obesity and dyslipidemia MERCK & CO., INC. (US) 2008-02-12 US disclosed
US-7329683-B2 11-β-hydroxysteroid dehydrogenase 1 inhibitors useful for the treatment of diabetes, obesity and dyslipidemia MERCK & CO., INC. (US) 2008-02-12 US disclosed
US-7329683-B2 11-β-hydroxysteroid dehydrogenase 1 inhibitors useful for the treatment of diabetes, obesity and dyslipidemia MERCK & CO., INC. (US) 2008-02-12 US disclosed
EP-1474139-B1 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 INHIBITORS USEFUL FOR THE TREATMENT OF DIABETES, OBESITY AND DYSLIPIDEMIA MERCK & CO INC (US) 2007-11-21 EP disclosed
US-20050070720-A1 11-Beta-hydroxysteroid dehydrogenase 1 inhibitors useful for the treatment of diabetes, obesity and dyslipidemia MERCK SHARP & DOHME CORP. 2005-03-31 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-20050070720-A1 11-Beta-hydroxysteroid dehydrogenase 1 inhibitors useful for the treatment of diabetes, obesity and dyslipidemia HSD11B1, HSD17B1, HSD11B2 HSD11B1 1/4885HSD17B1 2/4885HSD11B2 3/4885

“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.