SCHEMBL21156863

SCHEMBL21156863

CC(C)(C)OC(=O)NC1CCOc2ccccc2NC1=O

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 10/20 0.52
GAA P10253 1/20 0.49
EPHX2 P34913 1/20 0.47
BRD4 O60885 2/20 0.46
CREBBP Q92793 2/20 0.46
IDO1 P14902 1/20 0.41
MAPK10 P53779 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
SCHEMBL18368150 1.00 RIPK1 (0.52) RIPK1GAAEPHX2BRD4CREBBP
SCHEMBL3485743 0.88 GAA (0.57) RIPK1GAAEPHX2IDO1MAPK10
SCHEMBL1561667 0.88 GAA (0.57) RIPK1GAAEPHX2IDO1MAPK10
SCHEMBL1561665 0.88 GAA (0.57) RIPK1GAAEPHX2IDO1MAPK10
SCHEMBL21307358 0.88 EPHX2 (0.44) RIPK1GAAEPHX2BRD4CREBBP
SCHEMBL7986840 0.82 BRD4 (0.48) GAAEPHX2BRD4CREBBP
SCHEMBL29264385 0.82 BRD4 (0.48) GAAEPHX2BRD4CREBBP
SCHEMBL22048691 0.81 ACACB (0.42) RIPK1GAAEPHX2IDO1MAPK10
SCHEMBL5640963 0.80 EPHX2 (0.56) RIPK1GAAEPHX2
SCHEMBL1269023 0.80 EPHX2 (0.56) RIPK1GAAEPHX2

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
EP-3508484-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GlaxoSmithKline Intellectual Property Development Limited (GB) 2019-07-10 EP disclosed