SCHEMBL22907615

SCHEMBL22907615

Cc1ccc2c(c1)c1cc(C)ccc1n2-c1ccc2c(c1)Sc1cc(-n3c4ccc(C)cc4c4cc(C)ccc43)ccc1N2c1ccc2sc3ccccc3c2c1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.32
GRIN1 Q05586 2/20 0.32
GRIN2A Q12879 2/20 0.32
GPR3 P46089 1/20 0.31
BCHE P06276 1/20 0.30
PMM2 O15305 1/20 0.30
MPI P34949 1/20 0.30
PHOSPHO1 Q8TCT1 1/20 0.30

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
SCHEMBL22907699 0.98 ACHE (0.31) ACHEGRIN1GRIN2ABCHE
SCHEMBL22907582 0.93 PMM2 (0.31) PMM2MPIPHOSPHO1
SCHEMBL22907700 0.93
SCHEMBL22907697 0.90 G6PD (0.30)
SCHEMBL22907590 0.88 GPR3 (0.36) GPR3
SCHEMBL22907583 0.87 PMM2 (0.34) PMM2MPIPHOSPHO1
SCHEMBL22907661 0.86 BCHE (0.36) ACHEGPR3BCHE
SCHEMBL22907555 0.86 GPR3 (0.30) GPR3
SCHEMBL22907698 0.86 PIM3 (0.32) GPR3
SCHEMBL22907580 0.85 PMM2 (0.33) PMM2MPIPHOSPHO1

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
US-20210020854-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND POLYCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2021-01-21 US disclosed