SCHEMBL4691029

SCHEMBL4691029

CCOC(=O)C(CCC1(CCN2CCC(NC(=O)c3occc3-c3ccc(C)cc3)CC2)CCCCC1)(C(=O)OCC)C(=O)OCC

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.35
MCHR1 Q99705 5/20 0.34
SSTR5 P35346 4/20 0.34
HTR7 P34969 1/20 0.33
HRH3 Q9Y5N1 2/20 0.33
KCNH2 Q12809 1/20 0.33
LMNA P02545 1/20 0.32
ALDH1A1 P00352 2/20 0.32
POLB P06746 1/20 0.32
RAB9A P51151 1/20 0.32
HSD17B10 Q99714 1/20 0.32
KDM4E B2RXH2 1/20 0.32
KMT2A Q03164 1/20 0.32
CNR1 P21554 1/20 0.32

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
SCHEMBL5107097 0.91 L3MBTL1 (0.36) L3MBTL1MCHR1HRH3KCNH2LMNA
SCHEMBL4690596 0.89 PDE10A (0.35) L3MBTL1SSTR5HTR7KCNH2ALDH1A1
SCHEMBL4691461 0.85 MCHR1 (0.38) L3MBTL1MCHR1HTR7HRH3LMNA
SCHEMBL4690432 0.85 MCHR1 (0.39) L3MBTL1MCHR1HRH3LMNAALDH1A1
SCHEMBL4687521 0.85 MCHR1 (0.32) L3MBTL1MCHR1HTR7HRH3ALDH1A1
SCHEMBL4690036 0.85 MCHR1 (0.36) L3MBTL1MCHR1HTR7HRH3ALDH1A1
SCHEMBL4693190 0.84 L3MBTL1 (0.39) L3MBTL1MCHR1LMNAALDH1A1RAB9A
SCHEMBL4687554 0.84 L3MBTL1 (0.38) L3MBTL1MCHR1HRH3LMNAALDH1A1
SCHEMBL4688285 0.83 L3MBTL1 (0.36) L3MBTL1MCHR1HTR7ALDH1A1RAB9A
SCHEMBL4691176 0.83 KCNA3 (0.38) L3MBTL1MCHR1HRH3LMNAALDH1A1

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 4 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-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 L3MBTL1 4882/4885MCHR1 1825/4885SSTR5 3029/4885
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 L3MBTL1 3273/4885MCHR1 187/4885SSTR5 120/4885

“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.