SCHEMBL670912

SCHEMBL670912

CS(=O)(=O)OC1CCCCC1=O

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA4 P22748 1/20 0.45
KMT2A Q03164 2/20 0.43
MAPT P10636 2/20 0.40
ALDH1A1 P00352 4/20 0.39
USP2 O75604 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
KDM4E B2RXH2 3/20 0.38
HSD17B10 Q99714 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.36
MAOA P21397 4/20 0.36
MAOB P27338 1/20 0.35
MAPK1 P28482 1/20 0.33

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
SCHEMBL23467074 0.79 CA1 (0.40) CA1CA2CA4KMT2AMAPT
Ammonia Solution, Strong SCHEMBL5192485 0.78 CA1 (0.39) CA1CA2CA4KMT2AMAPT
SCHEMBL181970 0.76
SCHEMBL6912662 0.76
SCHEMBL1568359 0.76
SCHEMBL7871650 0.75 CA1 (0.48) CA1CA2CA4KMT2AMAPT
SCHEMBL5194718 0.75 CA1 (0.48) CA1CA2CA4KMT2AMAPT
SCHEMBL6916176 0.74 KMT2A (0.52) CA1CA2CA4KMT2AMAPT
SCHEMBL9874961 0.74 KMT2A (0.52) CA1CA2CA4KMT2AMAPT
Methylsulfanylmethane SCHEMBL15329055 0.73 CA1 (0.36) CA1CA2CA4KMT2AMAPT

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 CA1 2272/4885CA2 2293/4885CA4 1318/4885

“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.