SCHEMBL27359770

SCHEMBL27359770

Cn1nc2cccc(F)c2c1C#N

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 1/20 0.38
▸ LRRK2 Q5S007 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ DYRK1A Q13627 1/20 0.34
▸ PARP1 P09874 2/20 0.34
▸ MAOB P27338 1/20 0.34
▸ LMNA P02545 2/20 0.33
▸ PSMB8 P28062 1/20 0.33
▸ HSP90AB1 P08238 1/20 0.33
▸ GRM5 P41594 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ KAT2B Q92831 2/20 0.32
▸ L3MBTL1 Q9Y468 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) PDE10AALDH1A1PARP1LMNAPSMB8
SCHEMBL27359788 0.80 PDE10A (0.38) PDE10ALMNAPSMB8GRM5SLC9A1
SCHEMBL27359779 0.80 PSMB8 (0.46) ALDH1A1PARP1MAOBLMNAPSMB8
SCHEMBL27359777 0.73 PDE10A (0.38) PDE10ALRRK2ALDH1A1PARP1LMNA
SCHEMBL9389564 0.72 KDM4E (0.42) ALDH1A1MEN1KMT2ASLC9A1KEAP1
SCHEMBL28226985 0.71 PARP1 (0.35) PDE10AALDH1A1PARP1MAOBHSP90AB1
SCHEMBL13106207 0.71 HSP90AB1 (0.39) PDE10AALDH1A1PARP1MAOBHSP90AB1
SCHEMBL16252841 0.70 ALDH1A1 (0.43) PDE10ALRRK2ALDH1A1DYRK1ALMNA
SCHEMBL27359783 0.70 PTPN11 (0.39) LMNAPSMB8GRM5
SCHEMBL28192985 0.69 ALDH1A1 (0.34) ALDH1A1PARP1MAOBHSP90AB1MEN1

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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