SCHEMBL4690411

SCHEMBL4690411

Cc1ccc(N(C(=O)c2ccco2)C2CCN(CCC3(CCO[Si](c4ccccc4)(c4ccccc4)C(C)(C)C)CCN(Cc4ccccc4)CC3)CC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 4/20 0.54
CHRM3 P20309 4/20 0.54
OPRM1 P35372 8/20 0.50
OPRD1 P41143 2/20 0.50
OPRK1 P41145 2/20 0.50
CACNA2D1 P54289 2/20 0.46
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL13980683 0.85 CHRM2 (0.55) CHRM2CHRM3OPRM1OPRD1OPRK1
SCHEMBL4690016 0.85 CHRM2 (0.65) CHRM2CHRM3OPRM1OPRD1OPRK1
SCHEMBL28781738 0.79 CHRM2 (0.85) CHRM2CHRM3OPRM1OPRD1OPRK1
SCHEMBL5107103 0.79 OPRM1 (0.54) CHRM2CHRM3OPRM1OPRD1OPRK1
SCHEMBL14089010 0.78 POLB (0.42)
SCHEMBL4690013 0.77 OPRM1 (0.52) CHRM2CHRM3OPRM1OPRD1OPRK1
SCHEMBL4690629 0.77 OPRM1 (0.57) CHRM2CHRM3OPRM1OPRD1OPRK1
Hydrochloric Acid SCHEMBL1849691 0.76 OPRM1 (0.56) CHRM2CHRM3OPRM1OPRD1OPRK1
SCHEMBL4690583 0.76 OPRM1 (0.51) CHRM2CHRM3OPRM1OPRD1OPRK1
SCHEMBL4690361 0.76 OPRM1 (0.56) CHRM2CHRM3OPRM1OPRD1OPRK1

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-1443046-B1 NOVEL 4-(2FUROYL)AMINOPIPERIDINES, INTERMEDIATES IN SYNTHESIZING THE SAME, PROCESS FOR PRODUCING THE SAME AND MEDICINAL USE OF THE SAME KYORIN SEIYAKU KK (JP) 2008-12-17 EP disclosed
US-20080194826-A1 Novel 4-(2-furoyl) aminopiperidienes, intermediates for synthesizing the same, processes for preparing the same and medicinal use of the same KYORIN PHARMACEUTICAL CO., LTD. 2008-08-14 US disclosed
US-7375115-B2 4-(2-furoyl) aminopiperidines, intermediates in synthesizing the same, process for producing the same and medicinal use of the same KYORIN PHARMACEUTICAL CO., LTD. (JP) 2008-05-20 US disclosed
US-7375115-B2 4-(2-furoyl) aminopiperidines, intermediates in synthesizing the same, process for producing the same and medicinal use of the same KYORIN PHARMACEUTICAL CO., LTD. (JP) 2008-05-20 US disclosed
US-20050085508-A1 Novel 4-(2-furoyl) aminopiperidines, intermediates in synthesizing the same, process for producing the same and medicinal use of the same KYORIN PHARMACEUTICAL CO., LTD. (JP) 2005-04-21 US disclosed
EP-1443046-A1 NOVEL 4-(2FUROYL)AMINOPIPERIDINES, INTERMEDIATES IN SYNTHESIZING THE SAME, PROCESS FOR PRODUCING THE SAME AND MEDICINAL USE OF THE SAME Kyorin Pharmaceutical Co., Ltd. (JP) 2004-08-04 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 (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-20080194826-A1 Novel 4-(2-furoyl) aminopiperidienes, intermediates for synthesizing the same, processes for preparing the same and medicinal use of the same CYP4F2, CYP1A2, CYP4B1 CHRM2 1461/4885CHRM3 2162/4885OPRM1 250/4885
US-20050085508-A1 Novel 4-(2-furoyl) aminopiperidines, intermediates in synthesizing the same, process for producing the same and medicinal use of the same OPRM1, OPRD1, HRH4 CHRM2 22/4885CHRM3 39/4885OPRM1 1/4885

“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.