SCHEMBL17632604

SCHEMBL17632604

C#Cc1ccc(-c2cnc(N(C#N)C(=O)[C@H]3CCNC3)s2)cc1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ UCHL1 P09936 3/20 0.43
▸ USP30 Q70CQ3 4/20 0.39
▸ WNT1 P04628 1/20 0.35
▸ GSK3B P49841 1/20 0.35
▸ DYRK1A Q13627 1/20 0.35
▸ CHEK1 O14757 7/20 0.34
▸ CDK2AP1 O14519 1/20 0.34
▸ CTSC P53634 1/20 0.32
▸ KDM1A O60341 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
SCHEMBL17632487 0.94 USP30 (0.41) UCHL1USP30WNT1GSK3BDYRK1A
SCHEMBL17631539 0.91 USP30 (0.42) UCHL1USP30WNT1GSK3BDYRK1A
SCHEMBL17632491 0.90 CHEK1 (0.42) UCHL1USP30WNT1GSK3BDYRK1A
SCHEMBL17632016 0.89 USP30 (0.40) UCHL1USP30WNT1GSK3BDYRK1A
SCHEMBL17631830 0.89 USP30 (0.40) UCHL1USP30WNT1GSK3BDYRK1A
SCHEMBL17632036 0.89 USP30 (0.50) UCHL1USP30CHEK1
SCHEMBL17632047 0.88 USP30 (0.41) UCHL1USP30WNT1GSK3BDYRK1A
SCHEMBL17632442 0.87 CHEK1 (0.44) UCHL1USP30GSK3BCHEK1
SCHEMBL17632415 0.86 CHEK1 (0.41) UCHL1USP30WNT1GSK3BDYRK1A
SCHEMBL17632186 0.85 USP30 (0.40) UCHL1USP30WNT1GSK3BDYRK1A

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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