SCHEMBL19344751

SCHEMBL19344751

Cc1cccc(C)c1-c1nnc2c3ccccc3c3cc(Br)ccc3n12

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.42
PDE2A O00408 8/20 0.39
PDE10A Q9Y233 5/20 0.39
CASP3 P42574 1/20 0.34
TSPO P30536 1/20 0.33
MAPT P10636 3/20 0.33
LMNA P02545 1/20 0.33
PTGER4 P35408 1/20 0.32
PLA2G2A P14555 1/20 0.32
TP53 P04637 1/20 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
SCHEMBL10128852 0.83 PDE2A (0.43) POLBPDE2APDE10ATSPO
SCHEMBL515190 0.82 POLB (0.50) POLBPDE2APDE10AMAPT
SCHEMBL10128829 0.82 POLB (0.44) POLBPDE2APDE10ATSPOMAPT
SCHEMBL10128846 0.81 PDE2A (0.46) POLBPDE2APDE10AMAPT
SCHEMBL10128840 0.81 POLB (0.52) POLBPDE2APDE10AMAPT
SCHEMBL10128842 0.80 POLB (0.48) POLBPDE2APDE10AMAPT
SCHEMBL10128851 0.79 POLB (0.44) POLBPDE2APDE10AMAPT
SCHEMBL10128863 0.79 POLB (0.42) POLBPDE2APDE10AMAPT
SCHEMBL10128534 0.78 POLB (0.41) POLBPDE2APDE10AMAPTLMNA
SCHEMBL19344797 0.77 POLB (0.39) POLBPDE2AMAPTTP53

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017153760-A1 ORGANIC LIGHT-EMITTING DEVICE CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2017-09-14 WO disclosed