SCHEMBL17632335

SCHEMBL17632335

N#CN(C(=O)[C@H]1CCNC1)c1cc(-c2ccccc2)cnn1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 7/20 0.41
▸ GABRA1 P14867 3/20 0.38
▸ GABRG2 P18507 3/20 0.38
▸ GABRB3 P28472 3/20 0.38
▸ GABRA5 P31644 3/20 0.38
▸ GABRA3 P34903 3/20 0.38
▸ CDK9 P50750 1/20 0.34
▸ F10 P00742 1/20 0.33
▸ FAAH O00519 2/20 0.32
▸ PIK3CD O00329 1/20 0.32
▸ PIM1 P11309 1/20 0.32
▸ PIK3CA P42336 1/20 0.32
▸ PIK3CG P48736 1/20 0.32
▸ GSK3B P49841 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
SCHEMBL17632095 0.83 USP30 (0.41) USP30CDK9F10FAAHGSK3B
SCHEMBL17632326 0.83 USP30 (0.49) USP30CDK9F10FAAH
SCHEMBL17631943 0.83 USP30 (0.49) USP30CDK9F10FAAH
SCHEMBL17631671 0.83 USP30 (0.41) USP30CDK9F10FAAHGSK3B
SCHEMBL17631874 0.79 USP30 (0.51) USP30CDK9F10
SCHEMBL17632381 0.78 USP30 (0.48) USP30
SCHEMBL17632261 0.78 HPGDS (0.41) USP30CDK9F10
SCHEMBL17632600 0.77 CDK9 (0.39) CDK9
SCHEMBL17632116 0.76 CDK9 (0.38) USP30CDK9
SCHEMBL17631936 0.76 USP30 (0.37) USP30CDK9

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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