SCHEMBL30869642

SCHEMBL30869642

Cc1cc2c(cc1-c1ccc3[nH]ncc3c1)Oc1cc(-c3ccc4[nH]ncc4c3)cnc1N2CCCN1C[C@]2(C)COC[C@]2(C)C1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.35
MAP3K11 Q16584 1/20 0.35
TNIK Q9UKE5 1/20 0.35
ROCK2 O75116 3/20 0.35
ROCK1 Q13464 3/20 0.35
TRPA1 O75762 2/20 0.34
CHRNA7 P36544 2/20 0.34
BACE1 P56817 1/20 0.33
KCNH2 Q12809 1/20 0.33
GRIA1 P42261 2/20 0.32
MAP4K4 O95819 1/20 0.32
ERBB2 P04626 1/20 0.32
MAPK9 P45984 1/20 0.32
CSNK1D P48730 1/20 0.32
PRKD2 Q9BZL6 1/20 0.32
SLK Q9H2G2 1/20 0.32
MAPK14 Q16539 2/20 0.31
MAPKAPK2 P49137 1/20 0.31
LRRK2 Q5S007 1/20 0.31
BRD4 O60885 1/20 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
SCHEMBL30869716 0.93 GRIA1 (0.36) EGFRMAP3K11TNIKROCK2ROCK1
SCHEMBL30869623 0.92 GRIA1 (0.36) EGFRMAP3K11TNIKROCK2ROCK1
SCHEMBL30869726 0.92 EGFR (0.38) EGFRMAP3K11TNIKROCK2ROCK1
SCHEMBL30869695 0.92 EGFR (0.38) EGFRMAP3K11TNIKROCK2ROCK1
SCHEMBL30869417 0.91 GRIA1 (0.36) EGFRMAP3K11TNIKROCK2ROCK1
SCHEMBL30869483 0.88 EGFR (0.47) EGFRMAP3K11TNIKROCK2ROCK1
SCHEMBL30869751 0.87 GRIA1 (0.35) EGFRMAP3K11TNIKROCK2ROCK1
SCHEMBL30869773 0.86 EGFR (0.45) EGFRMAP3K11TNIKROCK2ROCK1
SCHEMBL30869481 0.85 EGFR (0.44) EGFRMAP3K11TNIKROCK2ROCK1
SCHEMBL30869772 0.84 EGFR (0.40) EGFRROCK2ROCK1TRPA1CHRNA7

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