SCHEMBL3845684

SCHEMBL3845684

CCCCNC(C)c1ccccc1C1c2ccccc2-c2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.50
ACHE P22303 1/20 0.50
POLB P06746 3/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
ATM Q13315 1/20 0.36
ALDH1A1 P00352 2/20 0.36
MAPT P10636 2/20 0.36
APAF1 O14727 1/20 0.36
HTR2A P28223 2/20 0.36
CA2 P00918 1/20 0.35
KCNH2 Q12809 3/20 0.33
SLC6A2 P23975 3/20 0.33
SLC6A4 P31645 3/20 0.33
OPRM1 P35372 3/20 0.33
DRD3 P35462 3/20 0.33
CASR P41180 3/20 0.33
KCNA5 P22460 2/20 0.33
ADRA2C P18825 2/20 0.33
HTR2C P28335 2/20 0.33

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
SCHEMBL3211270 0.80 BCHE (0.35) BCHEACHEPOLBKMT2AALDH1A1
SCHEMBL3211563 0.77 ALDH1A1 (0.33) BCHEACHEPOLBALDH1A1MAPT
SCHEMBL8733843 0.75 ACHE (0.56) BCHEACHEPOLBKMT2AMEN1
SCHEMBL3190427 0.75 SIGMAR1 (0.38) BCHEACHEPOLBKMT2AMEN1
SCHEMBL11044330 0.73 ADRB2 (0.46) POLBKMT2AMEN1ALDH1A1MAPT
SCHEMBL3202576 0.73 BCHE (0.53) BCHEACHECA2CHRM1CYP2D6
SCHEMBL3213756 0.72 MEN1 (0.40) BCHEACHEPOLBKMT2AMEN1
SCHEMBL3192965 0.72 MEN1 (0.44) POLBKMT2AMEN1ATMALDH1A1
SCHEMBL28856362 0.71 GABRA1 (0.41) POLBKMT2AMEN1ATMHTR2A
SCHEMBL3215805 0.71 BCHE (0.35) BCHEACHEPOLBALDH1A1MAPT

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-1426379-B1 TRANSITION METAL COMPLEX,CATALYST FOR OLEFIN POLYMERIZATION, AND PROCESS FOR PRODUCING OLEFIN POLYMER WITH THE SAME SUMITOMO CHEMICAL CO (JP) 2009-11-11 EP disclosed
US-7439379-B2 Transition metal complex, catalyst for olefin polymerization, and process for producing olefin polymer with the same SUMITOMO CHEMICAL CO., LTD. (JP) 2008-10-21 US disclosed