SCHEMBL30869601

SCHEMBL30869601

Brc1cnc2c(c1)Oc1cc(Br)cnc1N2CCCCN1C[C@H]2C[C@@H]1CO2

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
WNT1 P04628 3/20 0.33
GSK3B P49841 3/20 0.33
DYRK1A Q13627 3/20 0.33
KRAS P01116 2/20 0.32
KCNH2 Q12809 1/20 0.32
MCHR1 Q99705 1/20 0.32
KIF11 P52732 2/20 0.32
ADK P55263 1/20 0.30

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
SCHEMBL30869401 1.00 ESR1 (0.33) ESR1ESR2WNT1GSK3BDYRK1A
SCHEMBL30869444 0.99 ESR1 (0.33) ESR1ESR2WNT1GSK3BDYRK1A
SCHEMBL30869687 0.99 ESR1 (0.33) ESR1ESR2WNT1GSK3BDYRK1A
SCHEMBL30869520 0.92 PIM1 (0.33) ESR1ESR2WNT1GSK3BDYRK1A
SCHEMBL30869555 0.92 PIM1 (0.33) ESR1ESR2WNT1GSK3BDYRK1A
SCHEMBL30869679 0.91 PIM1 (0.32) ESR1ESR2WNT1GSK3BDYRK1A
SCHEMBL30869639 0.91 PIM1 (0.32) ESR1ESR2WNT1GSK3BDYRK1A
SCHEMBL30869399 0.89 ESR1 (0.36) ESR1ESR2WNT1GSK3BDYRK1A
SCHEMBL30869588 0.89 ESR1 (0.36) ESR1ESR2WNT1GSK3BDYRK1A
SCHEMBL30869778 0.89 KIF11 (0.32) KIF11

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