SCHEMBL29908200

SCHEMBL29908200

N#CN1CCCC1CNc1nc2ccc(-c3cn[nH]c3)cc2s1

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 7/20 0.72
OTUD7B Q6GQQ9 1/20 0.50
PCSK9 Q8NBP7 1/20 0.45
LCK P06239 6/20 0.42
ITK Q08881 6/20 0.42
MAP4K1 Q92918 1/20 0.41
ROCK2 O75116 3/20 0.40
PIK3CD O00329 1/20 0.39
PI4KA P42356 1/20 0.39
PIK3CG P48736 1/20 0.39
PI4KB Q9UBF8 1/20 0.39

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
SCHEMBL18987081 0.84 USP30 (1.00) USP30OTUD7BPCSK9
SCHEMBL29908149 0.81 USP30 (0.74) USP30OTUD7BPCSK9LCKITK
SCHEMBL19017747 0.79 USP30 (0.77) USP30OTUD7BPCSK9LCKITK
SCHEMBL24977487 0.76 USP30 (0.72) USP30OTUD7BPCSK9LCKITK
SCHEMBL18987364 0.75 USP30 (0.65) USP30OTUD7BPCSK9LCKITK
SCHEMBL17631790 0.74 USP30 (0.75) USP30OTUD7BLCKITKMAP4K1
SCHEMBL17631787 0.74 USP30 (0.75) USP30OTUD7BLCKITKMAP4K1
SCHEMBL18987257 0.73 USP30 (1.00) USP30OTUD7BPCSK9LCKITK
SCHEMBL18987182 0.72 USP30 (0.65) USP30OTUD7BPCSK9LCKITK
SCHEMBL20051382 0.70 USP30 (1.00) USP30OTUD7BLCKITK

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4122929-A1 NOVEL COMPOUNDS Mission Therapeutics Limited (GB) 2023-01-25 EP disclosed
EP-3390391-B1 NOVEL COMPOUNDS MISSION THERAPEUTICS LTD (GB) 2022-09-14 EP disclosed