SCHEMBL17424112

SCHEMBL17424112

CCOC(=O)Nc1nn(C(c2ccccc2)(c2ccccc2)c2ccccc2)c2cc(NC(=O)N[C@H](C)c3ccccc3)ncc12

nearest known ligand 0.63

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 20/20 0.63

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
SCHEMBL17113789 0.91 MAPK1 (0.64) MAPK1
SCHEMBL16964521 0.90 MAPK1 (0.62) MAPK1
SCHEMBL16965656 0.88 MAPK1 (0.62) MAPK1
SCHEMBL16965598 0.88 MAPK1 (0.62) MAPK1
SCHEMBL16965576 0.88 MAPK1 (0.61) MAPK1
SCHEMBL16965574 0.88 MAPK1 (0.61) MAPK1
SCHEMBL16965030 0.88 MAPK1 (0.61) MAPK1
SCHEMBL16965032 0.88 MAPK1 (0.61) MAPK1
SCHEMBL16964807 0.87 MAPK1 (0.64) MAPK1
SCHEMBL16964804 0.87 MAPK1 (0.64) 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
US-9233979-B2 Compounds that are ERK inhibitors MERCK SHARP & DOHME CORP. (US) 2016-01-12 — — US disclosed
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