SCHEMBL20303147

SCHEMBL20303147

CC(C)(C)OC(=O)N1CCC(OCC2CCCC2)CC1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 10/20 0.58
EPHX1 P07099 1/20 0.52
HPGD P15428 1/20 0.51
RECQL P46063 1/20 0.46
KDM4E B2RXH2 1/20 0.44
PKM P14618 1/20 0.44
PRMT5 O14744 1/20 0.44
WDR77 Q9BQA1 1/20 0.44

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
SCHEMBL2149117 0.97 GPR119 (0.58) GPR119EPHX1HPGDRECQLKDM4E
SCHEMBL4097772 0.94 GPR119 (0.60) GPR119EPHX1HPGDRECQLKDM4E
SCHEMBL470837 0.91 GPR119 (0.67) GPR119EPHX1HPGDRECQLKDM4E
Ethylene SCHEMBL8479448 0.90 GPR119 (0.57) GPR119EPHX1HPGDRECQLKDM4E
SCHEMBL26635122 0.89 GPR119 (0.58) GPR119EPHX1HPGDRECQLKDM4E
SCHEMBL4715715 0.87 GPR119 (0.55) GPR119EPHX1HPGDRECQLKDM4E
SCHEMBL25974405 0.86 GPR119 (0.53) GPR119EPHX1HPGDRECQLKDM4E
SCHEMBL29768079 0.86 GPR119 (0.53) GPR119EPHX1HPGDRECQLKDM4E
SCHEMBL15412881 0.86 GPR119 (0.61) GPR119EPHX1HPGDRECQLKDM4E
SCHEMBL1243247 0.85 GPR119 (0.52) GPR119EPHX1HPGDRECQLPRMT5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11230556-B2 6,5-fused heteroaryl piperidine ether allosteric modulators of the M4 muscarinic acetylcholine receptor MERCK SHARP & DOHME CORP. (US) 2022-01-25 US disclosed
EP-3558306-B1 6,5-FUSED HETEROARYL PIPERIDINE ETHER ALLOSTERIC MODULATORS OF THE M4 MUSCARINIC ACETYLCHOLINE RECEPTOR MERCK SHARP & DOHME (US) 2021-07-07 EP disclosed
US-20200095261-A1 6,5-FUSED HETEROARYL PIPERIDINE ETHER ALLOSTERIC MODULATORS OF THE M4 MUSCARINIC ACETYLCHOLINE RECEPTOR MERCK SHARP & DOHME CORP. (US) 2020-03-26 US disclosed
EP-3558306-A1 6,5-FUSED HETEROARYL PIPERIDINE ETHER ALLOSTERIC MODULATORS OF THE M4 MUSCARINIC ACETYLCHOLINE RECEPTOR Merck Sharp & Dohme Corp. (US) 2019-10-30 EP disclosed
WO-2018118736-A1 6,5-FUSED HETEROARYL PIPERIDINE ETHER ALLOSTERIC MODULATORS OF THE M4 MUSCARINIC ACETYLCHOLINE RECEPTOR MERCK SHARP & DOHME CORP. (US) 2018-06-28 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 (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-11230556-B2 6,5-fused heteroaryl piperidine ether allosteric modulators of the M4 muscarinic acetylcholine receptor CHRM5, CHRM4, CHRM2 GPR119 237/4885EPHX1 590/4885HPGD 2863/4885
US-20200095261-A1 6,5-FUSED HETEROARYL PIPERIDINE ETHER ALLOSTERIC MODULATORS OF THE M4 MUSCARINIC ACETYLCHOLINE RECEPTOR CHRM5, CHRM4, CHRM2 GPR119 237/4885EPHX1 590/4885HPGD 2863/4885

“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.