SCHEMBL3719396

SCHEMBL3719396

CN(CC(=O)N1CCC(c2cc(C(=O)N3CCCC4CCCCC43)cs2)CC1)C(=O)OC(C)(C)C

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 7/20 0.59
POLB P06746 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CNR2 P34972 1/20 0.36
HSD17B1 P14061 1/20 0.33
HTR2C P28335 3/20 0.31
SLC6A4 P31645 3/20 0.31
NR1H2 P55055 1/20 0.31
NR1H3 Q13133 1/20 0.31
CTSD P07339 1/20 0.31
CTSL P07711 1/20 0.31
CTSB P07858 1/20 0.31
CTSS P25774 1/20 0.31
UCHL1 P09936 1/20 0.30
USP30 Q70CQ3 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
SCHEMBL13124610 0.87 HSD11B1 (0.69) HSD11B1POLBTDP1CNR2HSD17B1
SCHEMBL3794865 0.84 HSD11B1 (0.60) HSD11B1POLBTDP1CNR2NR1H2
SCHEMBL3794868 0.84 HSD11B1 (0.60) HSD11B1POLBTDP1CNR2NR1H2
SCHEMBL3796683 0.84 HSD11B1 (0.60) HSD11B1POLBTDP1CNR2NR1H2
SCHEMBL3719394 0.81 HSD11B1 (0.38) HSD11B1
SCHEMBL13124661 0.81 HSD11B1 (0.68) HSD11B1POLBTDP1CNR2HSD17B1
SCHEMBL3795300 0.80 HSD11B1 (0.69) HSD11B1POLBTDP1CNR2HSD17B1
SCHEMBL3795303 0.80 HSD11B1 (0.69) HSD11B1POLBTDP1CNR2HSD17B1
SCHEMBL13124751 0.79 HSD11B1 (0.63) HSD11B1POLBTDP1CNR2HSD17B1
SCHEMBL13124586 0.79 HSD11B1 (0.70) HSD11B1POLBTDP1CNR2HSD17B1

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-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
EP-2229374-A1 AMIDO-THIOPHENE COMPOUNDS AND THEIR USE AS 11-BETA-HSD1 INHIBITORS THE UNIVERSITY OF EDINBURGH (GB) 2010-09-22 EP disclosed
WO-2009074789-A1 AMIDO-THIOPHENE COMPOUNDS AND THEIR USE AS 11-BETA-HSD1 INHIBITORS THE UNIVERSITY OF EDINBURGH (GB) 2009-06-18 WO 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 1/4885POLB 3451/4885TDP1 643/4885

“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.