SCHEMBL4948458

SCHEMBL4948458

CC(OCCN)OC(C(=O)O)C(=O)OC(C)(C)C

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GABRR1 P24046 2/20 0.31
NOS1 P29475 2/20 0.30
NOS3 P29474 1/20 0.30
NOS2 P35228 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
SCHEMBL3617070 0.77 MEN1 (0.30)
SCHEMBL4948450 0.77 MEN1 (0.30)
SCHEMBL30874619 0.75 NOS1 (0.35) NOS1NOS3NOS2
SCHEMBL3393447 0.71 CYP2D6 (0.33)
SCHEMBL674128 0.69 CPB1 (0.34) NOS1NOS3NOS2
SCHEMBL29086267 0.69 CPB1 (0.32) NOS1NOS3NOS2
SCHEMBL617763 0.69 KMT2A (0.34) NOS1NOS3NOS2
Acetic Acid SCHEMBL9715511 0.68 GABRR1 (0.39) GABRR1
SCHEMBL28841424 0.68 CTH (0.34) GABRR1
SCHEMBL30831230 0.68 NOS1 (0.30) NOS1NOS3NOS2

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-1618195-B1 METHOD FOR SELECTIVE INHIBITION OF HUMAN N-MYC GENE IN N-MYC EXPRESSING TUMORS THROUGH ANTISENSE AND SENSE PEPPTIDO-NUCLEIC ACIDS (PNA) UNIV BOLOGNA ALMA MATER (IT) 2008-03-12 EP disclosed
US-20070020632-A1 Method for selective inhibition of human n-myc gene in n-myc expressing tumors through antisense and antigen peptido-nucleic acids (pna) BIOGENERA S.P.A. (IT) 2007-01-25 US disclosed
EP-1618195-A2 METHOD FOR SELECTIVE INHIBITION OF HUMAN N-MYC GENE IN N-MYC EXPRESSING TUMORS THROUGH ANTISENSE AND ANTIGEN PEPTIDO-NUCLEIC ACIDS (PNA) UNIVERSITA DEGLI STUDI DI BOLOGNA (IT) 2006-01-25 EP disclosed
WO-2004096826-A2 METHOD FOR SELECTIVE INHIBITION OF HUMAN N-MYC GENE IN N-MYC EXPRESSING TUMORS THROUGH ANTISENSE AND ANTIGEN PEPTIDO-NUCLEIC ACIDS (PNA) UNIVERSITA' DEGLI STUDI DI BOLOGNA (IT) 2004-11-11 WO disclosed