SCHEMBL479768

SCHEMBL479768

COC(=O)c1ccc2c(c1)NC(=O)/C2=C\CCNc1ccc(CN(C)C)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 1/20 0.40
PSEN2 P49810 1/20 0.40
APH1B Q8WW43 1/20 0.40
NCSTN Q92542 1/20 0.40
APH1A Q96BI3 1/20 0.40
PSENEN Q9NZ42 1/20 0.40
PDPK1 O15530 1/20 0.39
AURKA O14965 1/20 0.39
RAF1 P04049 1/20 0.39
KMT2A Q03164 1/20 0.37
CTDSP1 Q9GZU7 1/20 0.37
POLB P06746 1/20 0.37
CSF1R P07333 1/20 0.36
CA1 P00915 3/20 0.35
CA2 P00918 3/20 0.35
TGM2 P21980 2/20 0.35
CASP1 P29466 1/20 0.35
AURKB Q96GD4 5/20 0.35
FLT3 P36888 4/20 0.35
PDGFRB P09619 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
SCHEMBL479844 0.94 PSEN1 (0.39) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL479557 0.92 MAPT (0.41) KMT2ACSF1RCA1CA2FLT3
SCHEMBL479405 0.87 PIM1 (0.43) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL479406 0.87 PIM1 (0.43) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL16752525 0.85 AURKA (0.38) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL16752524 0.85 AURKA (0.38) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2121225 0.84 PSEN1 (0.42) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2569923 0.84 PSEN1 (0.42) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL479770 0.84 KMT2A (0.40) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL479685 0.83 CHEK1 (0.37) PSEN1PSEN2APH1BNCSTNAPH1A

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