SCHEMBL769864

SCHEMBL769864

O=C(CCCCNC(=S)NC12CCCC(CCC1)C2)N1CCCC2CCCC=C21.[CH2]

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 10/20 0.40
ACHE P22303 3/20 0.32
BCHE P06276 2/20 0.32
CHRM1 P11229 1/20 0.32
BACE1 P56817 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2B Q13224 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CCR3 P51677 1/20 0.31
ALDH1A1 P00352 3/20 0.31
NPC1 O15118 1/20 0.31
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL770473 0.94 EPHX2 (0.33) EPHX2ALDH1A1NPC1LMNAHTT
SCHEMBL15377530 0.91 EPHX2 (0.51) EPHX2MEN1KMT2AALDH1A1NPC1
SCHEMBL786865 0.89 MEN1 (0.38) EPHX2MEN1KMT2ACCR3ALDH1A1
SCHEMBL770873 0.89 EPHX2 (0.48) EPHX2MEN1KMT2ACCR3ALDH1A1
SCHEMBL772545 0.85 ALDH1A1 (0.39) EPHX2MEN1KMT2ACCR3ALDH1A1
SCHEMBL15377306 0.85 EPHX2 (0.46) EPHX2ALDH1A1NPC1LMNAHTT
SCHEMBL772172 0.82 EPHX2 (0.52) EPHX2MEN1KMT2AALDH1A1NPC1
SCHEMBL770834 0.81 QPCT (0.33) ALDH1A1NPC1RAB9A
SCHEMBL15377671 0.80 EPHX2 (0.50) EPHX2MEN1KMT2ACCR3ALDH1A1
SCHEMBL771393 0.80 KMT2A (0.41) MEN1KMT2AALDH1A1NPC1LMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 EPHX2 1153/4885ACHE 677/4885BCHE 291/4885

“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.