SCHEMBL771393

SCHEMBL771393

O=C(CCCCNC(=S)NC1CCCC1)N1CCCC2CCCC=C21

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 3/20 0.39
HRH2 P25021 1/20 0.39
GAA P10253 1/20 0.38
QPCT Q16769 1/20 0.38
NPC1 O15118 3/20 0.37
RAB9A P51151 3/20 0.37
ALOX12 P18054 1/20 0.37
KEAP1 Q14145 1/20 0.37
NFE2L2 Q16236 1/20 0.37
EPHX1 P07099 1/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL770270 0.99 KMT2A (0.42) KMT2AMEN1SMN1; SMN2LMNAHRH2
SCHEMBL15377790 0.96 KMT2A (0.43) KMT2AMEN1SMN1; SMN2LMNAHRH2
SCHEMBL770332 0.93 LMNA (0.39) KMT2AMEN1SMN1; SMN2LMNAGAA
SCHEMBL769979 0.92 NPC1 (0.41) KMT2AMEN1SMN1; SMN2LMNAGAA
SCHEMBL770322 0.88 EPHX1 (0.50) SMN1; SMN2GAANPC1RAB9AEPHX1
SCHEMBL770654 0.88 EPHX1 (0.50) SMN1; SMN2GAANPC1RAB9AEPHX1
SCHEMBL770888 0.86 ADAMTS4 (0.35) SMN1; SMN2ALOX12KEAP1NFE2L2ALDH1A1
SCHEMBL772557 0.85 EPHX2 (0.50) SMN1; SMN2GAANPC1RAB9AEPHX1
SCHEMBL769987 0.85 EPHX2 (0.50) SMN1; SMN2GAANPC1RAB9AEPHX1
SCHEMBL770834 0.84 QPCT (0.33) QPCTNPC1RAB9AKEAP1NFE2L2

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 KMT2A 3868/4885MEN1 827/4885SMN1; SMN2 3653/4885
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 KMT2A 3893/4885MEN1 823/4885SMN1; SMN2 3637/4885

“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.