SCHEMBL3799198

SCHEMBL3799198

COC(=O)N1CCC(c2cc(C(=O)N3CCCC4CCCC=C43)cs2)CC1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.41
BRD4 O60885 1/20 0.36
BRDT Q58F21 1/20 0.36
PDE4B Q07343 4/20 0.35
PDE4A P27815 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 1/20 0.35
HPGD P15428 2/20 0.32
MAPK1 P28482 1/20 0.32
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
HIF1A Q16665 1/20 0.31
PROKR1 Q8TCW9 4/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
GFER P55789 1/20 0.30
MCHR1 Q99705 1/20 0.30

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
SCHEMBL3794863 0.89 KDM4E (0.41) HSD11B1PDE4BHPGDALDH1A1MEN1
SCHEMBL3793168 0.89 HSD11B1 (0.40) HSD11B1BRD4PDE4BHPGDMAPK1
SCHEMBL3802525 0.87 HSD11B1 (0.39) HSD11B1PDE4BHPGDMAPK1ALDH1A1
SCHEMBL3793163 0.86 HSD11B1 (0.38) HSD11B1PDE4BHPGDMAPK1
SCHEMBL3793179 0.86 HSD11B1 (0.38) HSD11B1HPGDMAPK1
SCHEMBL3794744 0.85 HSD11B1 (0.37) HSD11B1
SCHEMBL14648156 0.85 HSD11B1 (0.45) HSD11B1HPGDMAPK1
SCHEMBL3795298 0.84 HSD11B1 (0.43) HSD11B1HPGDMAPK1
SCHEMBL3792413 0.83 HSD11B1 (0.34) HSD11B1HPGDMAPK1
SCHEMBL3795715 0.82 HSD11B1 (0.43) HSD11B1HPGDMAPK1ALDH1A1MEN1

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-8362008-B2 Amido-thiophene compounds and their use as 11-beta-HSD1 inhibitors THE UNIVERSITY OF EDINBURGH (GB) 2013-01-29 US disclosed
US-20100267696-A1 Amido-Thiophene Compounds and Their Use as 11-Beta-HSD1 Inhibitors THE UNIVERSITY OF EDINBURGH 2010-10-21 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-20100267696-A1 Amido-Thiophene Compounds and Their Use as 11-Beta-HSD1 Inhibitors HSD11B1, HSD11B2, HSD17B1 HSD11B1 1/4885BRD4 2616/4885BRDT 1910/4885

“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.