SCHEMBL769890

SCHEMBL769890

O=C(Cc1ccccc1)NCCCC(=O)N1CCCC2CCCC=C21

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.49
ALDH1A1 P00352 4/20 0.48
HPGD P15428 3/20 0.45
GAA P10253 1/20 0.44
NAMPT P43490 1/20 0.44
TRPV1 Q8NER1 2/20 0.43
CHRM4 P08173 1/20 0.41
DPP4 P27487 1/20 0.40
SIGMAR1 Q99720 3/20 0.40
LMNA P02545 1/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
PKM P14618 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
SCHEMBL770260 0.94 ALDH1A1 (0.46) ATMALDH1A1HPGDGAATRPV1
SCHEMBL771993 0.90 MEN1 (0.51) ALDH1A1HPGDNAMPTLMNAKMT2A
SCHEMBL771344 0.87 KEAP1 (0.46) HPGDDPP4LMNA
SCHEMBL772293 0.85 DPP4 (0.56) ALDH1A1GAANAMPTDPP4KMT2A
SCHEMBL771986 0.84 MEN1 (0.52) ALDH1A1HPGDNAMPTTRPV1DPP4
SCHEMBL771368 0.84 HPGD (0.50) ALDH1A1HPGDDPP4LMNAKMT2A
SCHEMBL771634 0.84 KEAP1 (0.48) HPGDDPP4LMNA
SCHEMBL769804 0.84 SIGMAR1 (0.47) ALDH1A1HPGDSIGMAR1
SCHEMBL770685 0.82 KEAP1 (0.42) ALDH1A1HPGDGAALMNAKMT2A
SCHEMBL771373 0.82 KEAP1 (0.41) ALDH1A1HPGDNAMPTCHRM4DPP4

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 ATM 3373/4885ALDH1A1 144/4885HPGD 50/4885
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 ATM 3394/4885ALDH1A1 142/4885HPGD 50/4885

“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.