SCHEMBL479844

SCHEMBL479844

COC(=O)c1ccc2c(c1)NC(=O)/C2=C\CCCNc1ccc(CN(C)C)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 1/20 0.39
PSEN2 P49810 1/20 0.39
APH1B Q8WW43 1/20 0.39
NCSTN Q92542 1/20 0.39
APH1A Q96BI3 1/20 0.39
PSENEN Q9NZ42 1/20 0.39
PDPK1 O15530 1/20 0.38
AURKA O14965 1/20 0.38
RAF1 P04049 1/20 0.38
KMT2A Q03164 1/20 0.36
CTDSP1 Q9GZU7 1/20 0.36
CASP1 P29466 1/20 0.36
POLB P06746 1/20 0.35
LMNA P02545 2/20 0.35
CYP1A2 P05177 1/20 0.35
MAOA P21397 1/20 0.35
CNR1 P21554 1/20 0.35
DRD4 P21917 1/20 0.35
ACHE P22303 1/20 0.35
HRH2 P25021 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
SCHEMBL479768 0.94 PSEN1 (0.40) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL479557 0.86 MAPT (0.41) KMT2ALMNACYP1A2MAOACNR1
SCHEMBL3721673 0.86 AURKA (0.37) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3721672 0.86 AURKA (0.37) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL479847 0.84 PDPK1 (0.39) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL479774 0.84 CHEK1 (0.36) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL479634 0.84 LMNA (0.40) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL479886 0.83 RAB9A (0.36) PDPK1AURKARAF1KMT2ACASP1
SCHEMBL2121225 0.83 PSEN1 (0.42) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2569923 0.83 PSEN1 (0.42) 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