SCHEMBL17631859

SCHEMBL17631859

N#CN(C(=O)C1CCNC1)c1ccc(-c2ccncc2)cn1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 5/20 0.39
▸ ABL1 P00519 1/20 0.35
▸ CHEK1 O14757 2/20 0.35
▸ KDM1A O60341 1/20 0.35
▸ DYRK1B Q9Y463 1/20 0.35
▸ BRAF P15056 2/20 0.35
▸ TLR9 Q9NR96 2/20 0.34
▸ TLR8 Q9NR97 2/20 0.34
▸ TLR7 Q9NYK1 2/20 0.34
▸ PAX8 Q06710 1/20 0.33
▸ MKNK1 Q9BUB5 1/20 0.33
▸ MKNK2 Q9HBH9 1/20 0.33

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
SCHEMBL17631943 0.90 USP30 (0.49) USP30CHEK1
SCHEMBL17632326 0.90 USP30 (0.49) USP30CHEK1
SCHEMBL17631958 0.89 MKNK1 (0.45) USP30ABL1CHEK1KDM1ADYRK1B
SCHEMBL17632146 0.89 USP30 (0.41) USP30KDM1ATLR9TLR8TLR7
SCHEMBL17632076 0.85 USP30 (0.39) USP30ABL1
SCHEMBL17631696 0.83 USP30 (0.41) USP30ABL1KDM1ATLR9TLR8
SCHEMBL17632617 0.83 CDK9 (0.42) USP30CHEK1KDM1ADYRK1BMKNK1
SCHEMBL17632423 0.82 CDK9 (0.40) USP30ABL1
SCHEMBL17632787 0.82 MEN1 (0.40) USP30KDM1A
SCHEMBL17631951 0.82 SLC6A2 (0.38) CHEK1

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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