SCHEMBL5098790

SCHEMBL5098790

c1ccc(Cn2c(C3CC3)nnc2C23CC4CC(CC(C4)C2)C3)cc1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.46
HSD11B1 P28845 5/20 0.45
ALDH1A1 P00352 4/20 0.45
MAPT P10636 1/20 0.45
AVPR1A P37288 5/20 0.44
GAA P10253 1/20 0.42
ATM Q13315 1/20 0.42
OPRK1 P41145 1/20 0.41
LMNA P02545 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
KDM4E B2RXH2 1/20 0.40
TSHR P16473 2/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL5092071 0.80 HSD11B1 (0.63) HSD11B1ALDH1A1GAAOPRK1LMNA
SCHEMBL5104580 0.78 HSD11B1 (0.47) HSD11B1ALDH1A1OPRK1MEN1KMT2A
SCHEMBL5098640 0.77 HSD11B1 (0.60) HSD11B1ALDH1A1GAAMEN1KMT2A
SCHEMBL5104754 0.77 HSD11B1 (0.67) HSD11B1MAPTAVPR1AOPRK1LMNA
SCHEMBL5095947 0.76 HSD11B1 (0.44) HSD11B1ALDH1A1GAAMEN1KMT2A
SCHEMBL5105050 0.76 HSD11B1 (0.54) HSD17B10HSD11B1ALDH1A1MAPTOPRK1
SCHEMBL5098035 0.76 HSD11B1 (0.57) HSD17B10HSD11B1ALDH1A1MAPTGAA
SCHEMBL5097998 0.75 HSD11B1 (0.65) HSD11B1ALDH1A1GAAMEN1KMT2A
SCHEMBL5092265 0.74 HSD11B1 (0.43) HSD11B1ALDH1A1MAPTGAAMEN1
SCHEMBL5095935 0.74 HSD11B1 (0.49) HSD11B1GAAMEN1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 HSD17B10 22/4885HSD11B1 1/4885ALDH1A1 688/4885

“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.