SCHEMBL30869578

SCHEMBL30869578

C[C@@]12COC[C@]1(C)CN(CCN1c3ccc(-c4ccc5[nH]ncc5c4)cc3Oc3cc(-c4ccc5[nH]ncc5c4)ccc31)C2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.41
PRKD2 Q9BZL6 2/20 0.38
EGFR P00533 2/20 0.38
MAP4K4 O95819 2/20 0.38
MAPK9 P45984 2/20 0.38
ERBB2 P04626 1/20 0.38
CSNK1D P48730 1/20 0.38
SLK Q9H2G2 1/20 0.38
ROCK1 Q13464 6/20 0.38
ROCK2 O75116 5/20 0.38
CHRNA7 P36544 2/20 0.38
GSK3B P49841 5/20 0.38
CDK5 Q00535 5/20 0.38
DYRK1A Q13627 5/20 0.38
CLK2 P49760 3/20 0.38
CLK4 Q9HAZ1 3/20 0.38
CLK1 P49759 2/20 0.38
DYRK3 O43781 2/20 0.38
DYRK1B Q9Y463 2/20 0.38
CLK3 P49761 1/20 0.38

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
SCHEMBL30869772 0.94 EGFR (0.40) BACE1PRKD2EGFRMAP4K4MAPK9
SCHEMBL30869445 0.90 GRIA1 (0.43) BACE1PRKD2EGFRMAP4K4MAPK9
SCHEMBL30869695 0.87 EGFR (0.38) BACE1PRKD2EGFRMAP4K4MAPK9
SCHEMBL30869726 0.87 EGFR (0.38) BACE1PRKD2EGFRMAP4K4MAPK9
SCHEMBL30869426 0.84 GRIA1 (0.42) BACE1PRKD2EGFRMAP4K4MAPK9
SCHEMBL30869796 0.84 GRIA1 (0.42) BACE1PRKD2EGFRMAP4K4MAPK9
SCHEMBL30869822 0.83 GRIA1 (0.41) BACE1PRKD2EGFRMAP4K4MAPK9
SCHEMBL30869456 0.83 EGFR (0.53) PRKD2EGFRMAP4K4MAPK9ERBB2
SCHEMBL30869734 0.79 EGFR (0.55) PRKD2EGFRMAP4K4MAPK9ERBB2
SCHEMBL30869573 0.79 EGFR (0.53) PRKD2EGFRMAP4K4MAPK9ERBB2

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