SCHEMBL770559

SCHEMBL770559

O=C(CCC1CCCC1)NCCC(=O)N1CCC2CCCCC2C1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
ATM Q13315 1/20 0.46
TP53 P04637 1/20 0.46
HSD11B1 P28845 1/20 0.44
ITGB3 P05106 6/20 0.43
ITGA2B P08514 6/20 0.43
F2R P25116 6/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL770017 0.99 ALDH1A1 (0.46) ALDH1A1ATMTP53HSD11B1ITGB3
SCHEMBL771201 0.87 EPHX2 (0.42) ALDH1A1HSD11B1ITGB3ITGA2BF2R
SCHEMBL770442 0.82 HSD11B1 (0.42) HSD11B1ITGB3ITGA2BF2RKMT2A
SCHEMBL771920 0.80 ITGB3 (0.48) HSD11B1ITGB3ITGA2BF2RSMN1; SMN2
SCHEMBL771720 0.78 ITGB3 (0.50) ALDH1A1HSD11B1ITGB3ITGA2BF2R
SCHEMBL770788 0.78 GNAI3 (0.48) ALDH1A1HSD11B1ITGB3ITGA2BMEN1
SCHEMBL772340 0.78 HDAC3 (0.42) ALDH1A1ITGB3ITGA2BSMN1; SMN2
SCHEMBL771655 0.78 HSD11B1 (0.51) ALDH1A1ATMTP53HSD11B1MEN1
SCHEMBL771297 0.77 GNAI3 (0.50) MEN1KMT2A
SCHEMBL771597 0.77 ALDH1A1 (0.49) ALDH1A1ATMHSD11B1KMT2AHPGD

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 7 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-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 ALDH1A1 144/4885ATM 3373/4885TP53 3249/4885
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 ALDH1A1 142/4885ATM 3394/4885TP53 3229/4885

“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.