SCHEMBL29136074

SCHEMBL29136074

Nc1cc(Br)ccc1C(=O)NC(CO)c1cccc(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ DCAF1 Q9Y4B6 1/20 0.47
▸ MAPK1 P28482 19/20 0.47

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
SCHEMBL16679369 0.88 L3MBTL1 (0.50) MAPK1
SCHEMBL16679365 0.88 L3MBTL1 (0.50) MAPK1
SCHEMBL16679977 0.87 MAPK1 (0.52) MAPK1
SCHEMBL16679979 0.87 MAPK1 (0.52) MAPK1
SCHEMBL29136028 0.83 KEAP1 (0.56) —
SCHEMBL29136031 0.83 KEAP1 (0.56) —
SCHEMBL30656440 0.81 MAPK1 (0.50) DCAF1MAPK1
SCHEMBL29136051 0.81 MAPK1 (0.50) DCAF1MAPK1
SCHEMBL19025632 0.76 ALDH1A1 (0.56) DCAF1MAPK1
SCHEMBL28076662 0.76 ALDH1A1 (0.56) DCAF1MAPK1

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-117136186-A Selective inhibitors of ROCK1 and ROCK2 protein kinases and uses thereof 盖诺斯克公司 2023-11-28 — — CN disclosed
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