SCHEMBL8577663

SCHEMBL8577663

CCOC(=O)C1(Br)Oc2ccc(OC(C)=O)cc2OC1Br

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.37
ALDH1A1 P00352 6/20 0.36
KMT2A Q03164 4/20 0.36
MAPT P10636 2/20 0.36
USP2 O75604 2/20 0.36
MEN1 O00255 1/20 0.36
HTT P42858 1/20 0.36
KDM4E B2RXH2 5/20 0.36
HPGD P15428 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CA2 P00918 2/20 0.35
CA5A P35218 2/20 0.35
GSTP1 P09211 1/20 0.35
GAA P10253 3/20 0.34
GLA P06280 2/20 0.34
ACHE P22303 3/20 0.34
TP53 P04637 1/20 0.34
POLB P06746 1/20 0.34
KIF11 P52732 1/20 0.33
CYP3A4 P08684 1/20 0.33

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
SCHEMBL9259019 0.95 LMNA (0.37) LMNAALDH1A1KMT2AMAPTUSP2
SCHEMBL8581306 0.85 KDM4E (0.35) ALDH1A1MAPTHTTKDM4EHPGD
SCHEMBL7202177 0.81 ALDH1A1 (0.42) LMNAALDH1A1KMT2AMAPTMEN1
SCHEMBL9412117 0.79 LMNA (0.39) LMNAALDH1A1KMT2AMAPTUSP2
SCHEMBL2267166 0.69 LMNA (0.48) LMNAALDH1A1KMT2AMAPTUSP2
SCHEMBL7204613 0.68 CYP4F2 (0.46) LMNAALDH1A1KMT2AMEN1HTT
SCHEMBL11001655 0.67 LMNA (0.44) LMNAALDH1A1KMT2AMAPTUSP2
SCHEMBL9254561 0.66 CYP4F2 (0.46) LMNAALDH1A1KMT2AMEN1HTT
SCHEMBL22396834 0.65 MRGPRX4 (0.49) LMNAALDH1A1KMT2AMAPTUSP2
SCHEMBL11005433 0.64 LMNA (0.41) LMNAALDH1A1KMT2AMAPTUSP2

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-0934317-A2 NOVEL 6 OR 7 SUBSTITUTED ANALOGUES OF SWAINSONINE, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS THERAPEUTIC AGENTS Glycodesign Inc. (CA) 1999-08-11 EP disclosed
US-5807882-A ANTITUMOR AGENTS ADIR ET COMPAGNIE (FR) 1998-09-15 US disclosed
WO-1998014445-A2 NOVEL 6 OR 7 SUBSTITUTED ANALOGUES OF SWAINSONINE, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS THERAPEUTIC AGENTS GLYCODESIGN INC. (CA) 1998-04-09 WO disclosed
US-5439909-A 2-Substituted with amide or thioamide group; antioxidant for lipoproteins, antilipemic agents, anticholesterol agents ADIR ET COMPAGNIE (FR) 1995-08-08 US disclosed
US-5420132-A Antilipemic agents ADIR ET COMPAGNIE (FR) 1995-05-30 US disclosed