SCHEMBL769664

SCHEMBL769664

O=C(CCSC(=O)N1CCCC2CCCCC21)NCCCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.50
FKBP1A P62942 7/20 0.48
HSD11B1 P28845 1/20 0.45
EPHX1 P07099 1/20 0.45
NAMPT P43490 1/20 0.44
DPP4 P27487 1/20 0.44
DPP8 Q6V1X1 1/20 0.44
DPP7 Q9UHL4 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
GAA P10253 1/20 0.43
HPGD P15428 1/20 0.43

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
SCHEMBL770377 0.94 DPP4 (0.50) EPHX2HSD11B1EPHX1DPP4DPP8
SCHEMBL771316 0.87 HSD11B1 (0.48) FKBP1AHSD11B1DPP4DPP8DPP7
SCHEMBL769995 0.84 EPHX2 (0.54) EPHX2L3MBTL1FKBP1AHSD11B1EPHX1
SCHEMBL770626 0.84 EPHX2 (0.54) EPHX2L3MBTL1FKBP1AHSD11B1EPHX1
SCHEMBL770482 0.84 EPHX2 (0.62) EPHX2L3MBTL1FKBP1AHSD11B1EPHX1
SCHEMBL770625 0.84 EPHX2 (0.62) EPHX2L3MBTL1FKBP1AHSD11B1EPHX1
SCHEMBL771992 0.82 MEN1 (0.55) EPHX2L3MBTL1FKBP1AHSD11B1NAMPT
SCHEMBL771985 0.81 MEN1 (0.53) EPHX2L3MBTL1FKBP1AHSD11B1EPHX1
SCHEMBL771389 0.80 EPHX2 (0.56) EPHX2FKBP1AHSD11B1NAMPTDPP4
SCHEMBL770751 0.79 DPP4 (0.54) EPHX2HSD11B1DPP4DPP8DPP7

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-20130303522-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 LABORATORIOS SALVAT, S.A. (ES) 2013-11-14 US disclosed
US-8524894-B2 Inhibitor compounds of 11-beta-hydroxysteroid dehydrogenase type 1 LABORATORIOS SALVAT, S.A. (ES) 2013-09-03 US disclosed
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 LABORATORIOS SALVAT, S.A. (ES) 2012-03-22 US disclosed
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 LABORATORIOS SALVAT, S.A. (ES) 2012-03-22 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 (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-20130303522-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 EPHX2 1149/4885L3MBTL1 4097/4885FKBP1A 359/4885
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 EPHX2 1153/4885L3MBTL1 4090/4885FKBP1A 354/4885

“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.