SCHEMBL4686728

SCHEMBL4686728

COC(=O)c1ccccc1NC(=O)CC1(CCN2CCC(NC(=O)c3occc3-c3ccc(C)cn3)CC2)CCCCC1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.48
MAPK10 P53779 4/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
ALDH1A1 P00352 6/20 0.45
LMNA P02545 1/20 0.45
KDM4E B2RXH2 6/20 0.42
HPGD P15428 2/20 0.42
HSD17B10 Q99714 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
PDE10A Q9Y233 1/20 0.36
POLB P06746 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
SCHEMBL4688839 0.93 TSHR (0.39) TSHRMAPK10SMN1; SMN2ALDH1A1LMNA
SCHEMBL4687396 0.90 TSHR (0.53) TSHRMAPK10SMN1; SMN2ALDH1A1LMNA
SCHEMBL4689735 0.86 TSHR (0.37) TSHRMAPK10SMN1; SMN2ALDH1A1LMNA
SCHEMBL1847387 0.85 PDE10A (0.40) LMNAPDE10A
SCHEMBL4686983 0.84 PDE10A (0.41) PDE10A
SCHEMBL4686652 0.84 PDE10A (0.38) ALDH1A1LMNAKDM4EPDE10A
SCHEMBL4692372 0.84 POLB (0.38) TSHRMAPK10SMN1; SMN2ALDH1A1KDM4E
SCHEMBL4691747 0.83 PDE10A (0.37) ALDH1A1LMNAKDM4EPDE10A
SCHEMBL4687556 0.83 TSHR (0.43) TSHRMAPK10SMN1; SMN2ALDH1A1LMNA
SCHEMBL4686523 0.83 PDE10A (0.37) PDE10APOLB

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 TSHR 3215/4885MAPK10 2341/4885SMN1; 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 TSHR 570/4885MAPK10 2829/4885SMN1; 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.