SCHEMBL27359788

SCHEMBL27359788

Cn1nc2cccc(Br)c2c1C#N

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 1/20 0.38
▸ PDPK1 O15530 1/20 0.34
▸ PSMB8 P28062 1/20 0.33
▸ GRM5 P41594 1/20 0.33
▸ TP53 P04637 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ SLC9A1 P19634 1/20 0.31
▸ KEAP1 Q14145 1/20 0.31

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
SCHEMBL27359621 0.81 PDE10A (0.37) PDE10APSMB8GRM5LMNASLC9A1
SCHEMBL27359779 0.80 PSMB8 (0.46) PSMB8GRM5LMNA
SCHEMBL27359770 0.80 PDE10A (0.38) PDE10APSMB8GRM5LMNASLC9A1
SCHEMBL23663596 0.78 PTPN11 (0.38) LMNA
SCHEMBL16506376 0.75 PDE10A (0.38) PDE10APDPK1TP53LMNASLC9A1
SCHEMBL18496491 0.75 GRM2 (0.37) TP53LMNA
SCHEMBL31439989 0.74 BACE1 (0.38) PDE10APDPK1MAPTSLC9A1KEAP1
SCHEMBL28161565 0.74 PDPK1 (0.44) PDE10APDPK1SLC9A1KEAP1
SCHEMBL27229417 0.74 PDPK1 (0.37) PDE10APDPK1SLC9A1KEAP1
SCHEMBL9389564 0.72 KDM4E (0.42) MAPTSLC9A1KEAP1

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-2024026536-A1 ANTIVIRAL COMPOUNDS AND USES THEREOF GRIFFITH UNIVERSITY (AU) 2024-02-08 — — WO disclosed
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