SCHEMBL479403

SCHEMBL479403

CC/C(Nc1ccc(C(=O)O)cc1)=C1\C(=O)Nc2cc(C(=O)OC)ccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.44
CTDSP1 Q9GZU7 1/20 0.44
CASP1 P29466 1/20 0.43
MEN1 O00255 4/20 0.39
BACE1 P56817 2/20 0.39
RXFP1 Q9HBX9 1/20 0.39
L3MBTL1 Q9Y468 3/20 0.38
POLB P06746 2/20 0.38
TP53 P04637 1/20 0.38
THRB P10828 1/20 0.38
BLM P54132 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
MAPT P10636 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
ALDH1A1 P00352 3/20 0.37
LMNA P02545 2/20 0.37
STAT3 P40763 1/20 0.37
PDPK1 O15530 1/20 0.37

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
SCHEMBL2124024 1.00 KMT2A (0.44) KMT2ACTDSP1CASP1MEN1BACE1
SCHEMBL2124019 1.00 KMT2A (0.44) KMT2ACTDSP1CASP1MEN1BACE1
SCHEMBL2571856 0.92 CASP1 (0.44) KMT2ACTDSP1CASP1MEN1BACE1
SCHEMBL2571851 0.92 CASP1 (0.44) KMT2ACTDSP1CASP1MEN1BACE1
SCHEMBL480580 0.92 RXFP1 (0.48) KMT2AMEN1RXFP1L3MBTL1POLB
SCHEMBL480582 0.92 RXFP1 (0.48) KMT2AMEN1RXFP1L3MBTL1POLB
SCHEMBL2119697 0.88 KMT2A (0.43) KMT2ACTDSP1CASP1MEN1BACE1
SCHEMBL2572117 0.87 KMT2A (0.40) KMT2ACTDSP1CASP1MEN1BACE1
SCHEMBL479766 0.87 KMT2A (0.40) KMT2ACTDSP1CASP1MEN1BACE1
SCHEMBL2119693 0.87 KMT2A (0.40) KMT2ACTDSP1CASP1MEN1BACE1

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
EP-2411034-A1 PROMOTION OF NEURONAL INTEGRATION IN NEURAL STEM CELL GRAFTS Life & Brain GmbH (DE) 2012-02-01 EP disclosed
WO-2010108665-A1 PROMOTION OF NEURONAL INTEGRATION IN NEURAL STEM CELL GRAFTS LIFE & BRAIN GMBH (DE) 2010-09-30 WO disclosed