SCHEMBL4688170

SCHEMBL4688170

CC(C)(C)[Si](OCCC1(C(O)CCc2ccccc2)CCNCC1)(c1ccccc1)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
SMYD2 Q9NRG4 3/20 0.33
PSMB5 P28074 1/20 0.32
SLC6A4 P31645 2/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A3 Q01959 1/20 0.32
TACR1 P25103 1/20 0.30

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
SCHEMBL239747 0.75 SMYD2 (0.37) CYP3A4HTTSMN1; SMN2SMYD2SLC6A4
SCHEMBL4689741 0.70 SMYD2 (0.36) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL4402734 0.69 SMYD2 (0.41) CYP3A4HTTSMN1; SMN2SMYD2SLC6A4
SCHEMBL10004139 0.67 SMYD2 (0.40) CYP3A4HTTSMN1; SMN2SMYD2SLC6A4
SCHEMBL224828 0.67 SMYD2 (0.40) CYP3A4HTTSMN1; SMN2SMYD2SLC6A4
SCHEMBL6660786 0.67 SMYD2 (0.40) CYP3A4HTTSMN1; SMN2SMYD2SLC6A4
SCHEMBL21810811 0.67 CYP3A4 (0.37) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL21810823 0.66 SMYD2 (0.39) CYP3A4HTTSMN1; SMN2SMYD2SLC6A4
SCHEMBL5150650 0.66 SMYD2 (0.39) CYP3A4HTTSMN1; SMN2SMYD2SLC6A4
SCHEMBL4264816 0.66 CYP3A4 (0.38) CYP3A4HTTSMN1; SMN2SMYD2SLC6A4

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
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-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 CYP3A4 6/4885HTT 4673/4885SMN1; SMN2 4591/4885
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 CYP3A4 347/4885HTT 4867/4885SMN1; SMN2 3652/4885

“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.