SCHEMBL15224167

SCHEMBL15224167

NCCC(=O)N1CCC(=O)C2CCCCC21

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
TSHR P16473 1/20 0.40
KIF11 P52732 5/20 0.38
F2 P00734 2/20 0.32
DPP7 Q9UHL4 1/20 0.32
HSD11B1 P28845 2/20 0.32
SMYD3 Q9H7B4 1/20 0.32
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
LMNA P02545 1/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL15224165 0.82 TSHR (0.37) ALDH1A1TSHRHSD11B1
SCHEMBL770306 0.80 DRD2 (0.40) ALDH1A1TSHRHSD11B1MEN1NPC1
SCHEMBL2888368 0.77 ALDH1A1 (0.45) ALDH1A1TSHRHSD11B1
SCHEMBL2885558 0.77 ALDH1A1 (0.45) ALDH1A1TSHRHSD11B1
SCHEMBL2885555 0.77 ALDH1A1 (0.45) ALDH1A1TSHRHSD11B1
SCHEMBL2885557 0.77 ALDH1A1 (0.45) ALDH1A1TSHRHSD11B1
SCHEMBL15245957 0.75 TP53 (0.39) ALDH1A1TSHRNPC1RAB9AKMT2A
SCHEMBL771621 0.75 GNAI3 (0.37) ALDH1A1HSD11B1CHRM2CHRM4CHRM1
SCHEMBL770812 0.75 NPC1 (0.41) ALDH1A1TSHRHSD11B1NPC1RAB9A
SCHEMBL770682 0.74 DPP7 (0.48) KIF11DPP7HSD11B1NPC1RAB9A

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
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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 144/4885TSHR 3844/4885KIF11 2396/4885

“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.