Sr-3677

Sr-3677

SCHEMBL22145950

CN(C)CCOc1cc(-c2cn[nH]c2)ccc1NC(=O)[C@@H]1COc2ccccc2O1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 17/20 1.00
ROCK1 Q13464 4/20 1.00
AKT1 P31749 2/20 1.00
CDC42BPA Q5VT25 5/20 0.77
RPS6KB1 P23443 1/20 0.68

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
Sr-3677 SCHEMBL453528 1.00 ROCK2 (1.00) ROCK2ROCK1AKT1CDC42BPARPS6KB1
Sr-3677 SCHEMBL29378608 1.00 ROCK2 (1.00) ROCK2ROCK1AKT1CDC42BPARPS6KB1
Sr-3677 SCHEMBL30373321 0.99 ROCK2 (0.98) ROCK2ROCK1AKT1CDC42BPARPS6KB1
Sr-3677 SCHEMBL15842050 0.99 ROCK2 (0.98) ROCK2ROCK1AKT1CDC42BPARPS6KB1
Sr-3677 SCHEMBL29249231 0.99 ROCK2 (0.98) ROCK2ROCK1AKT1CDC42BPARPS6KB1
SCHEMBL12562728 0.97 ROCK2 (0.94) ROCK2ROCK1AKT1CDC42BPARPS6KB1
SCHEMBL12562733 0.97 ROCK2 (0.94) ROCK2ROCK1AKT1CDC42BPARPS6KB1
SCHEMBL12562553 0.94 ROCK2 (0.88) ROCK2ROCK1AKT1CDC42BPARPS6KB1
SCHEMBL1987562 0.91 ROCK2 (0.84) ROCK2ROCK1AKT1CDC42BPARPS6KB1
SCHEMBL1990233 0.91 ROCK2 (0.83) ROCK2ROCK1AKT1CDC42BPARPS6KB1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220074923-A1 METHODS OF IDENTIFYING PARKIN-MEDIATED MITOPHAGY ACTIVATING AGENTS THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2022-03-10 US disclosed
WO-2020124236-A1 METHODS OF IDENTIFYING PARKIN-MEDIATED MITOPHAGY ACTIVATING AGENTS THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2020-06-25 WO disclosed