SCHEMBL3386635

SCHEMBL3386635

CCOC(=O)C[C@H]1CC[C@H](OC(=O)OC(C)(C)C)N1OC(=O)OC(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL3383577 1.00 MEN1 (0.34) MEN1ALDH1A1TSHRKMT2A
SCHEMBL3382783 0.79
SCHEMBL3382234 0.74 CHRM2 (0.35)
SCHEMBL30899843 0.69 KMT2A (0.36) MEN1ALDH1A1TSHRKMT2A
SCHEMBL30899821 0.69 KMT2A (0.36) MEN1ALDH1A1TSHRKMT2A
SCHEMBL30899819 0.69 KMT2A (0.36) MEN1ALDH1A1TSHRKMT2A
SCHEMBL29496240 0.68 MEN1 (0.40) MEN1ALDH1A1TSHRKMT2A
SCHEMBL22075650 0.68 CHRM2 (0.42) MEN1ALDH1A1TSHRKMT2A
SCHEMBL1080880 0.67 ALDH1A1 (0.43) MEN1ALDH1A1TSHRKMT2A
SCHEMBL17686381 0.67 SRC (0.41) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1651649-B1 NOVEL CYANOPYRROLIDIDES, METHODS FOR THE PRODUCTION THEREOF, AND USE OF THE SAME AS MEDICATION SANOFI AVENTIS DEUTSCHLAND (DE) 2010-12-01 EP disclosed
EP-1651649-A1 NOVEL CYANOPYRROLIDIDES, METHODS FOR THE PRODUCTION THEREOF, AND USE OF THE SAME AS MEDICAMENTS Sanofi-Aventis Deutschland GmbH (DE) 2006-05-03 EP disclosed
WO-2005012308-A1 NOVEL CYANOPYRROLIDIDES, METHODS FOR THE PRODUCTION THEREOF, AND USE OF THE SAME AS MEDICAMENTS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2005-02-10 WO disclosed