SCHEMBL7913306

SCHEMBL7913306

CC(NN(CC(=O)O)C(=O)Cn1cnc2c(=O)[nH]c(NC(=O)OCc3ccccc3)nc21)C(=O)OC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.38
MEN1 O00255 1/20 0.38
TSHR P16473 1/20 0.38
KMT2A Q03164 1/20 0.38
HPGD P15428 1/20 0.36
PNP P00491 1/20 0.35
TK1 P04183 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
SCHEMBL458786 0.83 MEN1 (0.38) MEN1TSHRKMT2ATK1
SCHEMBL3139870 0.80 MEN1 (0.48) MEN1TSHRKMT2APNPTK1
SCHEMBL7900006 0.79 RAB9A (0.47) POLB
SCHEMBL7263683 0.76 L3MBTL1 (0.36) MEN1TSHRKMT2A
SCHEMBL14548981 0.74 MEN1 (0.42) MEN1TSHRKMT2APNPTK1
SCHEMBL21654897 0.74 RAF1 (0.43) POLBMEN1TSHRKMT2ATK1
SCHEMBL458787 0.74 CCNE2 (0.36) MEN1TSHRKMT2A
SCHEMBL24540183 0.74 MEN1 (0.50) MEN1TSHRKMT2ATK1
SCHEMBL11986875 0.73 RAF1 (0.45) POLBMEN1TSHRKMT2ATK1
SCHEMBL3132950 0.73 MEN1 (0.46) MEN1TSHRKMT2ATK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6204326-B1 ADDING PEPTIDE NUCLEIC ACID UNITS TO AN AMINE TERMINATED PEPTIDE NUCLEIC ACID OLIGOMER ON A SOLID PHASE SYNTHETIC RESIN; BIOSYNTHESIS ISIS PHARMACEUTICALS, INC. 2001-03-20 US disclosed
EP-0777678-B1 PNA COMBINATORIAL LIBRARIES AND IMPROVED METHODS OF SYNTHESIS ISIS PHARMACEUTICALS INC (US) 1999-10-13 EP disclosed