SCHEMBL17631539

SCHEMBL17631539

C#Cc1cccc(-c2cnc(N(C#N)C(=O)[C@H]3CCNC3)s2)c1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 6/20 0.42
▸ UCHL1 P09936 3/20 0.40
▸ CHEK1 O14757 6/20 0.40
▸ PDE4A P27815 1/20 0.32
▸ PDE4B Q07343 1/20 0.32
▸ PDE4C Q08493 1/20 0.32
▸ PDE4D Q08499 1/20 0.32
▸ WNT1 P04628 1/20 0.32
▸ GSK3B P49841 1/20 0.32
▸ DYRK1A Q13627 1/20 0.32
▸ PAX8 Q06710 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
SCHEMBL17632442 0.94 CHEK1 (0.44) USP30UCHL1CHEK1PDE4APDE4B
SCHEMBL17632604 0.91 UCHL1 (0.43) USP30UCHL1CHEK1WNT1GSK3B
SCHEMBL17632036 0.90 USP30 (0.50) USP30UCHL1CHEK1
SCHEMBL17632150 0.89 USP30 (0.43) USP30UCHL1CHEK1
SCHEMBL17632503 0.88 USP30 (0.42) USP30UCHL1CHEK1DYRK1A
SCHEMBL17632265 0.88 USP30 (0.42) USP30UCHL1CHEK1
SCHEMBL17632487 0.87 USP30 (0.41) USP30UCHL1CHEK1WNT1GSK3B
SCHEMBL17632483 0.87 USP30 (0.42) USP30UCHL1CHEK1
SCHEMBL17631604 0.85 DYRK1B (0.44) USP30UCHL1CHEK1WNT1GSK3B
SCHEMBL17631685 0.85 DYRK1B (0.44) USP30UCHL1CHEK1WNT1GSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3197883-A1 NOVEL COMPOUNDS Mission Therapeutics Limited (GB) 2017-08-02 — — EP claimed
WO-2016046530-A1 NOVEL COMPOUNDS MISSION THERAPEUTICS LTD (GB) 2016-03-31 — — WO claimed
EP-3197883-A1 NOVEL COMPOUNDS Mission Therapeutics Limited (GB) 2017-08-02 — — EP disclosed
WO-2016046530-A1 NOVEL COMPOUNDS MISSION THERAPEUTICS LTD (GB) 2016-03-31 — — WO disclosed
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