SCHEMBL28078178

SCHEMBL28078178

CC(C)(C)OC(=O)N1CCNC(Cc2ccccc2)C1.CC(C)C1CN(C(=O)OC(C)(C)C)CCN1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
CA4 P22748 2/20 0.47
CA9 Q16790 2/20 0.47
GPR119 Q8TDV5 2/20 0.46
JAK2 O60674 1/20 0.43
JAK1 P23458 1/20 0.43
USP30 Q70CQ3 4/20 0.41
MAPK1 P28482 1/20 0.41
STS P08842 1/20 0.41
KLK7 P49862 1/20 0.41
KLK5 Q9Y337 1/20 0.41
P2RX7 Q99572 2/20 0.40
ACHE P22303 1/20 0.39
KDM4E B2RXH2 1/20 0.39
PKM P14618 1/20 0.39
ABHD6 Q9BV23 1/20 0.38
DAGLA Q9Y4D2 1/20 0.38

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
SCHEMBL28078174 1.00 CA1 (0.47) CA1CA2CA4CA9GPR119
SCHEMBL3494790 0.92 CA1 (0.54) CA1CA2CA4CA9GPR119
SCHEMBL17058 0.92 CA1 (0.54) CA1CA2CA4CA9GPR119
SCHEMBL2943387 0.92 CA1 (0.54) CA1CA2CA4CA9GPR119
SCHEMBL1467860 0.82 USP2 (0.41) USP30MAPK1KDM4E
SCHEMBL10219119 0.82 USP2 (0.41) USP30MAPK1KDM4E
SCHEMBL4653746 0.82 USP2 (0.41) USP30MAPK1KDM4E
SCHEMBL16583198 0.82 STS (0.54) CA1CA2CA4CA9GPR119
SCHEMBL4972391 0.82 GPR119 (0.47) CA1CA2CA4CA9GPR119
SCHEMBL7047899 0.81 JAK2 (0.47) CA1CA2CA4CA9GPR119

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
CN-104046246-B The chemical-mechanical planarization of tungsten-containing substrate 气体产品与化学公司 2016-06-15 CN claimed
CN-104046246-B The chemical-mechanical planarization of tungsten-containing substrate 气体产品与化学公司 2016-06-15 CN disclosed