SCHEMBL479886

SCHEMBL479886

COC(=O)c1ccc2c(c1)NC(=O)/C2=C\CCCNc1ccc(N(CCN(C)C)S(C)(=O)=O)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.36
POLB P06746 2/20 0.36
NPC1 O15118 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
AURKB Q96GD4 3/20 0.35
FLT3 P36888 2/20 0.35
LMNA P02545 4/20 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
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
MAPK1 P28482 1/20 0.35
NTSR1 P30989 1/20 0.35
HRH1 P35367 1/20 0.35
DRD3 P35462 1/20 0.35
SCN1A P35498 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
SCHEMBL479339 0.88 MAPT (0.36) RAB9ANPC1SMN1; SMN2AURKBFLT3
SCHEMBL479888 0.88 POLB (0.36) RAB9APOLBNPC1SMN1; SMN2AURKB
SCHEMBL2119702 0.85 POLB (0.39) RAB9APOLBNPC1SMN1; SMN2AURKB
SCHEMBL2571394 0.85 POLB (0.39) RAB9APOLBNPC1SMN1; SMN2AURKB
SCHEMBL479774 0.85 CHEK1 (0.36) RAB9AAURKBFLT3LMNACYP1A2
SCHEMBL3721673 0.84 AURKA (0.37) RAB9APOLBAURKBFLT3LMNA
SCHEMBL3721672 0.84 AURKA (0.37) RAB9APOLBAURKBFLT3LMNA
SCHEMBL479844 0.83 PSEN1 (0.39) RAB9APOLBAURKBFLT3LMNA
SCHEMBL479685 0.81 CHEK1 (0.37) RAB9AAURKBFLT3LMNACYP1A2
SCHEMBL479847 0.79 PDPK1 (0.39) POLBAURKBFLT3LMNABLM

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