SCHEMBL17631555

SCHEMBL17631555

N#CN(C(=O)[C@H]1CCNC1)c1ncc(N2Cc3ccccc3C2)s1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 6/20 0.33
▸ CDK9 P50750 1/20 0.32
▸ UCHL1 P09936 2/20 0.32
▸ PARP1 P09874 1/20 0.31
▸ DPP4 P27487 1/20 0.31
▸ FAP Q12884 1/20 0.31
▸ DPP8 Q6V1X1 1/20 0.31
▸ RIPK1 Q13546 1/20 0.30
▸ CHRM4 P08173 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
SCHEMBL17631911 0.83 UCHL1 (0.45) CDK9UCHL1CHRM4
SCHEMBL17632036 0.80 USP30 (0.50) USP30UCHL1
SCHEMBL17632525 0.78 CHEK1 (0.41) USP30CDK9UCHL1
SCHEMBL17631689 0.78 SMN1; SMN2 (0.35) USP30CDK9
SCHEMBL17631780 0.77 USP30 (0.39) USP30CDK9UCHL1
SCHEMBL17631923 0.77 UCHL1 (0.50) USP30UCHL1RIPK1
SCHEMBL17632937 0.77 CHEK1 (0.37) USP30CDK9UCHL1CHRM4
SCHEMBL17631847 0.77 USP30 (0.37) USP30CDK9UCHL1
SCHEMBL17631604 0.75 DYRK1B (0.44) USP30UCHL1
SCHEMBL17632604 0.75 UCHL1 (0.43) USP30UCHL1

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
Send feedback