SCHEMBL771224

SCHEMBL771224

O=C(CN(CCc1ccc(Cl)cc1Cl)C(=O)CCCC(=O)N1CCCC2CCCCC21)NCCc1ccc(Cl)cc1Cl

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
METAP2 P50579 4/20 0.40
METAP1 P53582 1/20 0.40
MC5R P33032 9/20 0.40
MC4R P32245 4/20 0.39
MC3R P41968 4/20 0.39
MC1R Q01726 2/20 0.39
HPGD P15428 1/20 0.39
PLAAT3 P53816 1/20 0.38
PLAAT5 Q96KN8 1/20 0.38
PLAAT2 Q9NWW9 1/20 0.38
PLAAT4 Q9UL19 1/20 0.38
DRD2 P14416 1/20 0.38
DRD4 P21917 1/20 0.38

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
SCHEMBL769750 0.88 ALDH1A1 (0.48) KDM4EALDH1A1METAP2METAP1MC5R
SCHEMBL794761 0.88 DRD2 (0.33) KDM4EALDH1A1METAP2METAP1MC5R
SCHEMBL770170 0.85 DRD2 (0.38) ALDH1A1DRD2DRD4
SCHEMBL15385486 0.85 METAP2 (0.40) KDM4EALDH1A1METAP2METAP1MC5R
SCHEMBL794444 0.81 NPC1 (0.45) ALDH1A1
SCHEMBL771289 0.78 ADAM17 (0.41) ALDH1A1
SCHEMBL770524 0.77 ALDH1A1 (0.46) ALDH1A1HPGDPLAAT3PLAAT5PLAAT2
SCHEMBL770835 0.75 DRD2 (0.55) ALDH1A1HPGDDRD2DRD4
SCHEMBL770280 0.73 SMN1; SMN2 (0.58) ALDH1A1HPGDPLAAT3PLAAT5PLAAT2
SCHEMBL770839 0.73 DRD2 (0.47) ALDH1A1HPGDDRD2DRD4

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 KDM4E 4105/4885ALDH1A1 144/4885METAP2 3787/4885
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 KDM4E 4127/4885ALDH1A1 142/4885METAP2 3805/4885

“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.