SCHEMBL770322

SCHEMBL770322

O=C(NCCCCC(=O)N1CCCC2CCCC=C21)NC1CCCCC1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 15/20 0.50
EPHX2 P34913 5/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
GAA P10253 1/20 0.43

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
SCHEMBL770654 1.00 EPHX1 (0.50) EPHX1EPHX2NPC1RAB9ASMN1; SMN2
SCHEMBL772557 0.97 EPHX2 (0.50) EPHX1EPHX2NPC1RAB9ASMN1; SMN2
SCHEMBL769987 0.97 EPHX2 (0.50) EPHX1EPHX2NPC1RAB9ASMN1; SMN2
SCHEMBL770637 0.92 EPHX1 (0.48) EPHX1EPHX2NPC1RAB9ASMN1; SMN2
SCHEMBL771010 0.92 EPHX1 (0.48) EPHX1EPHX2NPC1RAB9ASMN1; SMN2
SCHEMBL770270 0.90 KMT2A (0.42) EPHX1NPC1RAB9ASMN1; SMN2GAA
SCHEMBL771393 0.88 KMT2A (0.41) EPHX1NPC1RAB9ASMN1; SMN2GAA
SCHEMBL15377790 0.86 KMT2A (0.43) EPHX2NPC1RAB9ASMN1; SMN2GAA
SCHEMBL771263 0.84 EPHX1 (0.39) EPHX1EPHX2
SCHEMBL771349 0.83 CACNA1H (0.37) NPC1RAB9ASMN1; SMN2

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 EPHX1 227/4885EPHX2 1149/4885NPC1 97/4885
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 EPHX1 232/4885EPHX2 1153/4885NPC1 104/4885

“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.