SCHEMBL770539

SCHEMBL770539

CN1CCN(C(=O)CC(=O)N2CCCC3CCCC=C32)CC1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 5/20 0.39
MAOB P27338 2/20 0.39
TDP1 Q9NUW8 1/20 0.37
MAPT P10636 1/20 0.36
F10 P00742 1/20 0.36
CACNA2D1 P54289 3/20 0.36
CACNA1B Q00975 3/20 0.36
CACNB1 Q02641 3/20 0.36
CACNA1C Q13936 3/20 0.36
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
POLB P06746 1/20 0.34
GAA P10253 1/20 0.34

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
SCHEMBL770754 0.90 HTT (0.41) KDM1AMAOBTDP1MAPTF10
SCHEMBL770844 0.88 KMT2A (0.36) TDP1MAPTALDH1A1POLBGAA
SCHEMBL771484 0.88 LMNA (0.30)
SCHEMBL769779 0.88 KDM1A (0.39) KDM1AMAOBTDP1MAPTALDH1A1
SCHEMBL770714 0.87 ALDH1A1 (0.41) TDP1MAPTALDH1A1L3MBTL1GAA
SCHEMBL770273 0.83 HTT (0.35) TDP1MAPTALDH1A1KDM4EL3MBTL1
SCHEMBL771268 0.82 HPGD (0.48) TDP1MAPTALDH1A1L3MBTL1POLB
SCHEMBL769674 0.82 ALDH1A1 (0.39) TDP1MAPTALDH1A1L3MBTL1POLB
SCHEMBL769909 0.81 KMT2A (0.41) KDM1ATDP1ALDH1A1KDM4E
SCHEMBL769758 0.81 TSHR (0.48) ALDH1A1

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
EP-2439202-B1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 SALVAT LAB SA (ES) 2016-04-20 EP disclosed
US-8822452-B2 Inhibitor compounds of 11-beta-hydroxysteroid dehydrogenase type 1 LABORATORIOS SALVAT, S.A. (ES) 2014-09-02 US disclosed
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

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 KDM1A 2065/4885MAOB 1576/4885TDP1 135/4885
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 KDM1A 2083/4885MAOB 1581/4885TDP1 134/4885

“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.