SCHEMBL19980166

SCHEMBL19980166

CC(C)(C)OCN[C@H]1CCc2cc(-c3nnn[nH]3)ccc2NC1=O

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 15/20 0.34
PYGL P06737 2/20 0.32
PYGM P11217 2/20 0.32
BRD4 O60885 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP11B1 P15538 1/20 0.30
CYP11B2 P19099 1/20 0.30
PDE3B Q13370 1/20 0.30
PDE3A Q14432 1/20 0.30

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
SCHEMBL15964717 0.82 RIPK1 (0.42) RIPK1PYGLPYGM
SCHEMBL15957171 0.78 RIPK1 (0.43) RIPK1PYGLPYGM
SCHEMBL15956781 0.74 MAPT (0.35) BRD4CYP1A2CYP11B1CYP11B2PDE3B
SCHEMBL15956786 0.74 MAPT (0.35) BRD4CYP1A2CYP11B1CYP11B2PDE3B
SCHEMBL17312837 0.72 GSK3B (0.32) RIPK1PDE3BPDE3A
SCHEMBL17312839 0.72 GSK3B (0.32) RIPK1PDE3BPDE3A
SCHEMBL15964811 0.70 RIPK1 (0.54) RIPK1PYGLPYGM
SCHEMBL17312793 0.70 RIPK1 (0.54) RIPK1PYGLPYGM
SCHEMBL15957161 0.67 GSK3B (0.47) CYP1A2CYP11B1CYP11B2PDE3BPDE3A
SCHEMBL8812696 0.65 PDE3B (0.59) BRD4CYP1A2CYP11B1CYP11B2PDE3B

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-3375780-B1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2020-06-03 EP disclosed
EP-2956452-B1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2018-03-21 EP disclosed