SCHEMBL2223037

SCHEMBL2223037

CC(C)C(C)(C)OC(=O)c1cccnc1N(C)C1CCN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 8/20 0.47
POLB P06746 1/20 0.44
GPR119 Q8TDV5 6/20 0.43
JAK2 O60674 2/20 0.41
JAK1 P23458 2/20 0.41
TRPV1 Q8NER1 1/20 0.40
VNN1 O95497 1/20 0.40

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
SCHEMBL2223041 1.00 USP30 (0.47) USP30POLBGPR119JAK2JAK1
SCHEMBL13822281 0.91 USP30 (0.47) USP30POLBGPR119JAK2JAK1
SCHEMBL13822282 0.91 USP30 (0.47) USP30POLBGPR119JAK2JAK1
SCHEMBL21783090 0.79 USP30 (0.58) USP30GPR119JAK2JAK1VNN1
SCHEMBL22087745 0.79 USP30 (0.58) USP30GPR119JAK2JAK1VNN1
SCHEMBL8406581 0.76 GPR119 (0.52) USP30POLBGPR119
SCHEMBL8409489 0.76 GPR119 (0.47) USP30POLBGPR119
SCHEMBL8409617 0.75 GPR119 (0.50) USP30POLBGPR119
SCHEMBL28834262 0.74 USP30 (0.48) USP30POLBGPR119JAK2JAK1
SCHEMBL28834263 0.74 USP30 (0.48) USP30POLBGPR119JAK2JAK1

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-2011088201-A1 VOLTAGE-GATED SODIUM CHANNEL BLOCKERS GLAXO GROUP LIMITED (GB) 2011-07-21 WO disclosed