SCHEMBL17631750

SCHEMBL17631750

N#CN(C(=O)C1CCNC1)c1nc2c(s1)CN(C(=O)O)CC2

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 18/20 0.38
▸ UCHL1 P09936 2/20 0.33
▸ MAPK14 Q16539 1/20 0.33
▸ SIGMAR1 Q99720 1/20 0.33
▸ PARK7 Q99497 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
SCHEMBL17632318 0.91 GRM5 (0.41) GRM5UCHL1MAPK14SIGMAR1PARK7
SCHEMBL17632462 0.89 FASN (0.35) GRM5UCHL1MAPK14SIGMAR1PARK7
SCHEMBL17631972 0.88 GRM5 (0.51) GRM5PARK7
SCHEMBL17631404 0.87 TLR9 (0.39) GRM5UCHL1MAPK14SIGMAR1PARK7
SCHEMBL17632276 0.87 F10 (0.41) —
SCHEMBL17632587 0.83 NPC1 (0.40) GRM5
SCHEMBL17631678 0.83 GRM5 (0.41) GRM5
SCHEMBL17631779 0.83 GRM5 (0.44) GRM5PARK7
SCHEMBL17632465 0.82 GRM5 (0.43) GRM5
SCHEMBL17632538 0.82 ALDH1A1 (0.51) —

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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