SCHEMBL30418190

SCHEMBL30418190

O=C(OC(c1ccccc1)(c1ccccc1)c1ccccc1)N1C2COCC1CN(Cc1c(-c3ccc(Cl)cc3)nc3ccccn13)C2

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KCNK3 O14649 19/20 0.64
▸ KCNK9 Q9NPC2 19/20 0.64
▸ KDM4E B2RXH2 1/20 0.54
▸ GAA P10253 1/20 0.54
▸ SLC2A1 P11166 1/20 0.54

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
SCHEMBL19807813 0.90 KCNK3 (0.78) KCNK3KCNK9KDM4EGAASLC2A1
SCHEMBL22636024 0.88 KCNK3 (0.68) KCNK3KCNK9KDM4EGAASLC2A1
SCHEMBL22636358 0.87 KCNK3 (0.68) KCNK3KCNK9KDM4EGAASLC2A1
SCHEMBL19807682 0.86 KCNK3 (0.69) KCNK3KCNK9KDM4EGAASLC2A1
SCHEMBL22635926 0.84 KCNK3 (0.70) KCNK3KCNK9KDM4EGAASLC2A1
SCHEMBL22636213 0.83 KCNK3 (0.68) KCNK3KCNK9KDM4EGAASLC2A1
SCHEMBL19807866 0.83 KCNK3 (0.77) KCNK3KCNK9
SCHEMBL19807864 0.83 KCNK3 (0.77) KCNK3KCNK9
SCHEMBL19807757 0.81 KCNK3 (0.68) KCNK3KCNK9KDM4EGAASLC2A1
SCHEMBL22916204 0.81 KCNK3 (0.77) KCNK3KCNK9

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-4452264-A1 COMBINATION OF A TASK1/3 CHANNEL BLOCKER WITH A NOREPINEPHRINE REUPTAKE INHIBITOR FOR THE TREATMENT OF SLEEP APNEA Bayer Aktiengesellschaft (DE) 2024-10-30 — — EP disclosed
WO-2023118126-A1 COMBINATION OF A TASK1/3 CHANNEL BLOCKER WITH A NOREPINEPHRINE REUPTAKE INHIBITOR FOR THE TREATMENT OF SLEEP APNEA BAYER AKTIENGESELLSCHAFT (DE) 2023-06-29 — — WO disclosed
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