SCHEMBL479370

SCHEMBL479370

COC(=O)c1ccc2c(c1)NC(=O)C2=CCNc1ccc(N(CCC(C)(C)N)C(C)=O)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 2/20 0.36
RAF1 P04049 1/20 0.36
PDPK1 O15530 1/20 0.35
AURKB Q96GD4 5/20 0.34
CSF1R P07333 4/20 0.34
TGM2 P21980 1/20 0.33
FLT3 P36888 7/20 0.33
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33
APH1B Q8WW43 1/20 0.33
NCSTN Q92542 1/20 0.33
APH1A Q96BI3 1/20 0.33
PSENEN Q9NZ42 1/20 0.33
PDGFRB P09619 1/20 0.33
CASP1 P29466 1/20 0.33
KMT2A Q03164 1/20 0.33
CTDSP1 Q9GZU7 1/20 0.33
KIT P10721 3/20 0.32
FLT4 P35916 3/20 0.32
KDR P35968 3/20 0.32

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
SCHEMBL479687 0.92 TGM2 (0.34) AURKARAF1PDPK1AURKBCSF1R
SCHEMBL479775 0.91 TGM2 (0.33) AURKARAF1PDPK1AURKBCSF1R
SCHEMBL479369 0.87 AURKA (0.37) AURKARAF1PDPK1AURKBCSF1R
SCHEMBL3709544 0.85 RXFP1 (0.36) AURKBCSF1RTGM2FLT3KMT2A
SCHEMBL2119189 0.84 KMT2A (0.36) AURKARAF1PDPK1AURKBCASP1
SCHEMBL479346 0.84 RXFP1 (0.35) AURKBCSF1RTGM2FLT3KDR
SCHEMBL2122025 0.82 KMT2A (0.35) PDPK1AURKBCSF1RCASP1KMT2A
SCHEMBL2120209 0.81 CASP1 (0.35) AURKBCSF1RCASP1KMT2ACTDSP1
SCHEMBL479685 0.79 CHEK1 (0.37) AURKARAF1PDPK1AURKBCSF1R
SCHEMBL479774 0.78 CHEK1 (0.36) AURKARAF1PDPK1AURKBCSF1R

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