SCHEMBL479847

SCHEMBL479847

COC(=O)c1ccc2c(c1)NC(=O)C2=CCCCNc1ccc(C(C)(C)N)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.39
KMT2A Q03164 2/20 0.39
CTDSP1 Q9GZU7 1/20 0.39
AURKB Q96GD4 5/20 0.38
AURKA O14965 1/20 0.38
RAF1 P04049 1/20 0.38
PSEN1 P49768 1/20 0.38
PSEN2 P49810 1/20 0.38
APH1B Q8WW43 1/20 0.38
NCSTN Q92542 1/20 0.38
APH1A Q96BI3 1/20 0.38
PSENEN Q9NZ42 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
TGM2 P21980 1/20 0.37
POLB P06746 2/20 0.36
CASP1 P29466 1/20 0.36
CSF1R P07333 1/20 0.36
FLT3 P36888 3/20 0.36
PDGFRA P16234 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
SCHEMBL479770 0.94 KMT2A (0.40) PDPK1KMT2ACTDSP1AURKBAURKA
SCHEMBL479559 0.86 RXFP1 (0.41) KMT2AAURKBTGM2CSF1RFLT3
SCHEMBL479844 0.84 PSEN1 (0.39) PDPK1KMT2ACTDSP1AURKBAURKA
SCHEMBL479775 0.84 TGM2 (0.33) PDPK1KMT2ACTDSP1AURKBAURKA
SCHEMBL479888 0.84 POLB (0.36) PDPK1KMT2ACTDSP1AURKBAURKA
SCHEMBL479634 0.83 LMNA (0.40) KMT2AAURKBPSEN1PSEN2APH1B
SCHEMBL479405 0.82 PIM1 (0.43) PDPK1KMT2ACTDSP1AURKBAURKA
SCHEMBL479406 0.82 PIM1 (0.43) PDPK1KMT2ACTDSP1AURKBAURKA
SCHEMBL3721673 0.81 AURKA (0.37) PDPK1KMT2ACTDSP1AURKBAURKA
SCHEMBL3721672 0.81 AURKA (0.37) PDPK1KMT2ACTDSP1AURKBAURKA

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