SCHEMBL770645

SCHEMBL770645

CCC(C)NC(=O)NCCCCC(=O)N1CCCC2CCCC=C21

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 7/20 0.40
EPHX1 P07099 2/20 0.34
KMT2A Q03164 2/20 0.34
HTT P42858 1/20 0.34
KDM4E B2RXH2 2/20 0.33
LMNA P02545 1/20 0.31
ALDH1A1 P00352 1/20 0.31
DPP4 P27487 1/20 0.31

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
SCHEMBL770988 0.93 EPHX2 (0.37) EPHX2EPHX1KMT2AHTTKDM4E
SCHEMBL771263 0.92 EPHX1 (0.39) EPHX2EPHX1KMT2AKDM4EDPP4
SCHEMBL770028 0.84 KMT2A (0.33) EPHX2EPHX1KMT2AKDM4ELMNA
SCHEMBL771349 0.82 CACNA1H (0.37) ALDH1A1DPP4
SCHEMBL770322 0.81 EPHX1 (0.50) EPHX2EPHX1
SCHEMBL770654 0.81 EPHX1 (0.50) EPHX2EPHX1
SCHEMBL770945 0.80 NAAA (0.36) KMT2AHTTLMNA
SCHEMBL771768 0.79 CCR3 (0.47) EPHX1KMT2AHTTKDM4ELMNA
SCHEMBL771634 0.78 KEAP1 (0.48) EPHX2EPHX1LMNADPP4
SCHEMBL772172 0.78 EPHX2 (0.52) EPHX2KMT2AHTTLMNAALDH1A1

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 EPHX2 1149/4885EPHX1 227/4885KMT2A 3868/4885
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 EPHX2 1153/4885EPHX1 232/4885KMT2A 3893/4885

“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.