SCHEMBL30869442

SCHEMBL30869442

c1cc2c(cc1-c1ccc3[nH]ncc3c1)Oc1cc(-c3ccc4[nH]ncc4c3)cnc1N2CCN1C[C@H]2C[C@@H]1CN2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 4/20 0.42
KCNH2 Q12809 1/20 0.42
ROCK2 O75116 11/20 0.39
ROCK1 Q13464 7/20 0.39
CDK5 Q00535 2/20 0.34
DYRK1A Q13627 2/20 0.34
DYRK3 O43781 1/20 0.34
CLK1 P49759 1/20 0.34
CLK2 P49760 1/20 0.34
CLK3 P49761 1/20 0.34
GSK3B P49841 1/20 0.34
CDK5R1 Q15078 1/20 0.34
DYRK2 Q92630 1/20 0.34
CLK4 Q9HAZ1 1/20 0.34
DYRK1B Q9Y463 1/20 0.34
BRAF P15056 2/20 0.34
USP30 Q70CQ3 1/20 0.34
LRRK2 Q5S007 1/20 0.34
AURKA O14965 1/20 0.33
CHUK O15111 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
SCHEMBL30869594 1.00 CHRNA7 (0.42) CHRNA7KCNH2ROCK2ROCK1CDK5
SCHEMBL30869799 1.00 CHRNA7 (0.42) CHRNA7KCNH2ROCK2ROCK1CDK5
SCHEMBL30869420 0.95 CHRNA7 (0.43) CHRNA7KCNH2ROCK2ROCK1CDK5
SCHEMBL30869630 0.95 CHRNA7 (0.43) CHRNA7KCNH2ROCK2ROCK1CDK5
SCHEMBL30869427 0.92 CHRNA7 (0.43) CHRNA7KCNH2ROCK2ROCK1CDK5
SCHEMBL30869763 0.91 CHRNA7 (0.40) CHRNA7KCNH2ROCK2ROCK1BRAF
SCHEMBL30869637 0.91 CHRNA7 (0.40) CHRNA7KCNH2ROCK2ROCK1BRAF
SCHEMBL30869436 0.87 TNIK (0.36) CHRNA7KCNH2ROCK2ROCK1BRAF
SCHEMBL30869429 0.86 CHRNA7 (0.55) CHRNA7KCNH2ROCK2ROCK1CDK5
SCHEMBL30869859 0.84 CHRNA7 (0.44) CHRNA7KCNH2ROCK2ROCK1CDK5

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
EP-4583868-A2 DYNAMIN ACTIVATORS Walden Biosciences, Inc. (US) 2025-07-16 EP disclosed
WO-2024054661-A2 DYNAMIN ACTIVATORS WALDEN BIOSCIENCES (US) 2024-03-14 WO disclosed