SCHEMBL669343

SCHEMBL669343

NOC(=O)C(=O)OC1CCCCC1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.45
CA1 P00915 3/20 0.40
CA2 P00918 3/20 0.40
CA12 O43570 2/20 0.40
CA9 Q16790 2/20 0.40
CYP2C19 P33261 1/20 0.40
NAAA Q02083 2/20 0.39
HTT P42858 1/20 0.38
STS P08842 4/20 0.37
CYP19A1 P11511 3/20 0.36
GPR35 Q9HC97 1/20 0.36
MMP1 P03956 1/20 0.35
MMP9 P14780 1/20 0.35
MMP12 P39900 1/20 0.35
FABP7 O15540 1/20 0.34
FABP5 Q01469 1/20 0.34

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
SCHEMBL2999385 0.88 EPHX1 (0.54) EPHX1CA1CA2CA12CA9
SCHEMBL11591531 0.85 EPHX1 (0.50) EPHX1CA1CA2CA12CA9
SCHEMBL6623051 0.83 EPHX1 (0.48) EPHX1CA1CA2CA12CA9
SCHEMBL6030789 0.79 EPHX1 (0.47) EPHX1CA1CA2CA12CA9
SCHEMBL3047405 0.79 EPHX1 (0.47) EPHX1CA1CA2CA12CA9
SCHEMBL27520173 0.78 EPHX1 (0.42) EPHX1CA1CA2CA12CA9
SCHEMBL20573315 0.78 EPHX1 (0.50) EPHX1CA1CA2CA12CA9
SCHEMBL7753330 0.77 EPHX1 (0.45) EPHX1CA1CA2CA12CA9
SCHEMBL1584701 0.77 EPHX1 (0.52) EPHX1CA1CA2CA12CA9
SCHEMBL28964356 0.76 EPHX1 (0.48) EPHX1CA1CA2CA12CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2605772-B1 PROCESS FOR PREPARING AMINOCYCLOHEXYL ETHER COMPOUNDS CARDIOME INTERNAT AG (CH) 2016-06-22 EP disclosed
US-20150259284-A1 PROCESS FOR PREPARING AMINOCYCLOHEXYL ETHER COMPOUNDS CARDIOME INTERNATIONAL SA (CH) 2015-09-17 US disclosed
US-9006460-B2 Process for preparing aminocyclohexyl ether compounds CARDIOME INTERNATIONAL AG (CH) 2015-04-14 US disclosed
EP-2605772-A2 PROCESS FOR PREPARING AMINOCYCLOHEXYL ETHER COMPOUNDS Merck Sharp & Dohme Corp. (US) 2013-06-26 EP disclosed
US-20130149751-A1 PROCESS FOR PREPARING AMINOCYCLOHEXYL ETHER COMPOUNDS CARDIOME INTERNATIONAL SA (CH) 2013-06-13 US disclosed
WO-2012024100-A2 PROCESS FOR PREPARING AMINOCYCLOHEXYL ETHER COMPOUNDS MERCK SHARP & DOHME CORP. (US) 2012-02-23 WO 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-20150259284-A1 PROCESS FOR PREPARING AMINOCYCLOHEXYL ETHER COMPOUNDS CYP3A43, CYP4B1, CYP3A4 EPHX1 163/4885CA1 2272/4885CA2 2293/4885

“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.