SCHEMBL20028870

SCHEMBL20028870

CC(C)(C)OC(=O)N1CCCC(F)(c2nnc(-c3cc(Br)ccn3)o2)C1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 7/20 0.46
GPR119 Q8TDV5 5/20 0.37
RORC P51449 1/20 0.36
JAK2 O60674 3/20 0.35
JAK1 P23458 3/20 0.35
SCD5 Q86SK9 1/20 0.35
MKNK1 Q9BUB5 2/20 0.34

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
SCHEMBL20028867 1.00 USP30 (0.46) USP30GPR119RORCJAK2JAK1
SCHEMBL29679555 1.00 USP30 (0.46) USP30GPR119RORCJAK2JAK1
SCHEMBL20028869 0.87 USP30 (0.48) USP30GPR119SCD5
SCHEMBL21145388 0.86 USP30 (0.51) USP30
SCHEMBL21145389 0.86 USP30 (0.51) USP30
SCHEMBL20028902 0.86 USP30 (0.67) USP30GPR119JAK2JAK1
SCHEMBL20028904 0.86 USP30 (0.67) USP30GPR119JAK2JAK1
SCHEMBL20028871 0.82 USP30 (0.67) USP30GPR119JAK2JAK1
SCHEMBL20029002 0.82 USP30 (0.65) USP30GPR119JAK2JAK1
SCHEMBL20029001 0.82 USP30 (0.65) USP30GPR119JAK2JAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018060691-A1 CYANO-SUBTITUTED HETEROCYCLES WITH ACTIVITY AS INHIBITORS OF USP30 MISSION THERAPEUTICS LIMITED (GB) 2018-04-05 WO disclosed