SCHEMBL328941

SCHEMBL328941

O=C(NC1CCCC(O)CCC1)OCc1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.69
ALDH1A1 P00352 2/20 0.68
GAA P10253 1/20 0.68
TSHR P16473 1/20 0.65
MEN1 O00255 1/20 0.60
KMT2A Q03164 1/20 0.60
DPP4 P27487 3/20 0.56
DPP7 Q9UHL4 3/20 0.56
KCNH2 Q12809 1/20 0.56
CTSL P07711 1/20 0.55
CTSB P07858 1/20 0.55
CTSK P43235 1/20 0.55
TLR4 O00206 1/20 0.51
EPHX2 P34913 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
Cyclobutylcarbamic Acid Benzyl Ester SCHEMBL332814 0.94 EPHX1 (0.76) EPHX1ALDH1A1GAATSHRMEN1
Cyclobutylcarbamic Acid Benzyl Ester SCHEMBL579215 0.93 EPHX1 (0.74) EPHX1ALDH1A1GAATSHRMEN1
SCHEMBL22042534 0.92 EPHX1 (0.62) EPHX1ALDH1A1GAATSHRMEN1
SCHEMBL21677225 0.92 EPHX1 (0.62) EPHX1ALDH1A1GAATSHRMEN1
SCHEMBL2206808 0.92 EPHX1 (0.62) EPHX1ALDH1A1GAATSHRMEN1
SCHEMBL19619011 0.92 EPHX1 (0.62) EPHX1ALDH1A1GAATSHRMEN1
SCHEMBL851220 0.91 ALDH1A1 (0.76) EPHX1ALDH1A1GAATSHRMEN1
SCHEMBL9555876 0.91 ALDH1A1 (0.76) EPHX1ALDH1A1GAATSHRMEN1
SCHEMBL761181 0.91 ALDH1A1 (0.76) EPHX1ALDH1A1GAATSHRMEN1
SCHEMBL7198149 0.91 EPHX1 (0.81) EPHX1ALDH1A1GAATSHRMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2007719-B1 INHIBITORS OF THE 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ENZYME ABBOTT LAB (US) 2012-05-02 EP disclosed
EP-2407452-A1 Inhibitors of the 11-beta-hydroxysteroid dehydrogenase Type 1 enzyme Abbott Laboratories (US) 2012-01-18 EP disclosed
US-7737137-B2 Inhibitors of the 11-beta-hydroxysteroid dehydrogenase Type 1 enzyme ABBOTT LABORATORIES (US) 2010-06-15 US disclosed
EP-2007719-A2 INHIBITORS OF THE 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ENZYME Abbott Laboratories (US) 2008-12-31 EP disclosed
US-20080312214-A1 Inhibitors of the 11-Beta-Hydroxysteroid Dehydrogenase Type 1 Enzyme ABBOTT LABORATORIES (US) 2008-12-18 US disclosed
US-7435833-B2 Inhibitors of the 11-beta-hydroxysteroid dehydrogenase Type 1 enzyme ABBOTT LABORATORIES (US) 2008-10-14 US disclosed
US-20080076819-A1 INHIBITORS OF THE 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ENZYME ABBOTT LABORATORIES (US) 2008-03-27 US disclosed
WO-2007118185-A2 INHIBITORS OF THE 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ENZYME ABBOTT LABORATORIES (US) 2007-10-18 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 (2 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-20080076819-A1 INHIBITORS OF THE 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ENZYME HSD11B1, HSD11B2, HSD17B1 EPHX1 492/4885ALDH1A1 132/4885GAA 451/4885
US-20080312214-A1 Inhibitors of the 11-Beta-Hydroxysteroid Dehydrogenase Type 1 Enzyme HSD11B1, HSD17B1, HSD11B2 EPHX1 453/4885ALDH1A1 62/4885GAA 517/4885

“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.