SCHEMBL12203953

SCHEMBL12203953

O[C@@H]1CCN(C2CCCCC2)C1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 1/20 0.40
▸ PHGDH O43175 1/20 0.39
▸ MGLL Q99685 1/20 0.39
▸ OPRM1 P35372 3/20 0.39
▸ OPRD1 P41143 3/20 0.39
▸ OPRK1 P41145 3/20 0.39
▸ OGFRL1 Q5TC84 3/20 0.39
▸ SLC18A3 Q16572 3/20 0.38
▸ POLB P06746 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ SIGMAR1 Q99720 3/20 0.36
▸ HRH3 Q9Y5N1 1/20 0.36
▸ TSHR P16473 1/20 0.35

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
SCHEMBL2632641 1.00 DPP4 (0.40) DPP4PHGDHMGLLOPRM1OPRD1
SCHEMBL6628519 1.00 DPP4 (0.40) DPP4PHGDHMGLLOPRM1OPRD1
SCHEMBL988738 0.98 DPP4 (0.37) DPP4PHGDHMGLLOPRM1OPRD1
SCHEMBL989317 0.98 DPP4 (0.37) DPP4PHGDHMGLLOPRM1OPRD1
SCHEMBL988739 0.98 DPP4 (0.37) DPP4PHGDHMGLLOPRM1OPRD1
Hydrochloric Acid SCHEMBL2875408 0.95 OPRM1 (0.36) DPP4PHGDHMGLLOPRM1OPRD1
Hydrochloric Acid SCHEMBL2875410 0.95 OPRM1 (0.36) DPP4PHGDHMGLLOPRM1OPRD1
Hydrochloric Acid SCHEMBL2876746 0.95 OPRM1 (0.36) DPP4PHGDHMGLLOPRM1OPRD1
SCHEMBL986628 0.93 OPRM1 (0.34) DPP4PHGDHMGLLOPRM1OPRD1
SCHEMBL897563 0.93 OPRM1 (0.34) DPP4PHGDHMGLLOPRM1OPRD1

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
US-9932350-B2 Inhibitors of IRAK4 activity MERCK SHARP & DOHME CORP. (US) 2018-04-03 — — US disclosed
US-20170217981-A1 INHIBITORS OF IRAK4 ACTIVITY MERCK SHARP & DOHME CORP. (US) 2017-08-03 — — US disclosed
US-9586899-B2 Synthetic process for aminocyclohexyl ether compounds CARDIOME PHARMA CORP. (CA) 2017-03-07 — — US disclosed
US-8692002-B2 Synthetic process for aminocyclohexyl ether compounds CARDIOME PHARMA CORP. (CA) 2014-04-08 — — US disclosed
EP-1666459-B1 Aminocyclohexyl ether compounds and uses thereof CARDIOME PHARMA CORP (CA) 2011-10-19 — — EP disclosed
EP-2298735-A1 Aminocyclohexyl ether compounds and uses thereof Cardiome Pharma Corp. (CA) 2011-03-23 — — EP 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-20170217981-A1 INHIBITORS OF IRAK4 ACTIVITY IRAK4, IRAK1, IRAK2 DPP4 84/4885PHGDH 4322/4885MGLL 3978/4885

“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.

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