SCHEMBL28970118

SCHEMBL28970118

CC(C)(C)OC(=O)C1NCc2c(Br)cc(O)cc21

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.33

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
SCHEMBL29097979 0.75 MAPKAPK2 (0.33) MAPK1
SCHEMBL29098070 0.74 MAPKAPK2 (0.33) MAPK1
SCHEMBL29710295 0.71 RECQL (0.34) MAPK1
SCHEMBL3128732 0.71 TSHR (0.41) MAPK1
SCHEMBL30677817 0.71 TSHR (0.41) MAPK1
SCHEMBL4574024 0.71 TSHR (0.41) MAPK1
Hydrochloric Acid SCHEMBL10959697 0.70 TSHR (0.43) MAPK1
SCHEMBL30829407 0.69 ESR2 (0.43)
SCHEMBL30829412 0.69 ESR2 (0.43)
SCHEMBL29829775 0.69 TDP2 (0.39) MAPK1

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
CN-115806561-A JAK3 selective inhibitors and uses thereof 南京药石科技股份有限公司 2023-03-17 CN disclosed