SCHEMBL25425858

SCHEMBL25425858

O=C(O)N1CC2CCC1CN2Cc1c(-c2ccc(Cl)cn2)nc2ccccn12

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ KCNK3 O14649 20/20 0.70
▸ KCNK9 Q9NPC2 20/20 0.70

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
SCHEMBL29432712 1.00 KCNK3 (0.70) KCNK3KCNK9
SCHEMBL22635923 0.93 KCNK3 (0.78) KCNK3KCNK9
SCHEMBL22636029 0.88 KCNK3 (0.90) KCNK3KCNK9
SCHEMBL29432807 0.88 KCNK3 (0.90) KCNK3KCNK9
SCHEMBL19807474 0.88 KCNK3 (0.64) KCNK3KCNK9
SCHEMBL31020923 0.88 KCNK3 (0.64) KCNK3KCNK9
SCHEMBL19807471 0.85 KCNK3 (0.62) KCNK3KCNK9
SCHEMBL29432659 0.85 KCNK3 (0.90) KCNK3KCNK9
SCHEMBL19807708 0.85 KCNK3 (0.90) KCNK3KCNK9
SCHEMBL19807496 0.85 KCNK3 (0.62) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023118122-A1 COMBINATION OF A TASK1/3 CHANNEL BLOCKER WITH A P2X3 RECEPTOR ANTAGONIST FOR THE TREATMENT OF SLEEP APNEA BAYER AKTIENGESELLSCHAFT (DE) 2023-06-29 — — WO disclosed
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