SCHEMBL22249180

SCHEMBL22249180

CC(Cc1ccc(-n2ccc(N)nc2=O)cc1)N1CC2C(CN)C2C1

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 4/20 0.36
MCHR1 Q99705 2/20 0.31

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
SCHEMBL22248398 1.00 ROCK2 (0.36) ROCK2MCHR1
SCHEMBL22248436 0.90 ROCK2 (0.35) ROCK2MCHR1
SCHEMBL22248961 0.89 ROCK2 (0.37) ROCK2MCHR1
SCHEMBL22249171 0.89 ROCK2 (0.37) ROCK2
SCHEMBL22249183 0.88 ROCK2 (0.37) ROCK2MCHR1
SCHEMBL22248440 0.88 ROCK2 (0.34) ROCK2MCHR1
SCHEMBL22249170 0.88 ROCK2 (0.35) ROCK2MCHR1
SCHEMBL22249175 0.85 ROCK2 (0.35) ROCK2MCHR1
SCHEMBL22248958 0.85 ROCK2 (0.35) ROCK2MCHR1
SCHEMBL22248422 0.85 ROCK2 (0.36) ROCK2

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
WO-2020150372-A1 ANTIMICROBIAL COMPOUNDS AND METHODS CURZA GLOBAL, LLC (US) 2020-07-23 WO disclosed