SCHEMBL770508

SCHEMBL770508

O=C(NCCC(=O)N1CCCC2CCCC=C21)NC1(c2cccs2)CCOCC1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.35
LMNA P02545 2/20 0.35
POLB P06746 1/20 0.35
THRB P10828 1/20 0.34
ALDH1A1 P00352 3/20 0.34
TP53 P04637 3/20 0.33
GAA P10253 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL770828 0.95 MAPT (0.35) MAPTLMNAPOLBTHRBALDH1A1
SCHEMBL770507 0.79 LMNA (0.37) MAPTLMNAPOLBTHRBALDH1A1
SCHEMBL770000 0.78 POLB (0.44) POLBALDH1A1SMN1; SMN2KDM4EKMT2A
SCHEMBL770298 0.75 GAA (0.46) MAPTLMNAALDH1A1TP53GAA
SCHEMBL15224215 0.75 LMNA (0.45) MAPTLMNAPOLBALDH1A1TP53
SCHEMBL770429 0.75 EPHX1 (0.47) LMNAALDH1A1
SCHEMBL15377730 0.74 HTT (0.50) LMNAALDH1A1HTTKMT2A
SCHEMBL770827 0.74 DPP4 (0.38) MAPTLMNAPOLBALDH1A1GAA
SCHEMBL770222 0.74 MEN1 (0.46) POLBALDH1A1KMT2A
SCHEMBL770246 0.73 EPHX2 (0.48) POLBALDH1A1HTTKMT2A

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-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 MAPT 618/4885LMNA 3155/4885POLB 375/4885
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 MAPT 638/4885LMNA 3116/4885POLB 358/4885

“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.