SCHEMBL31020930

SCHEMBL31020930

CC(C)c1ccc(-c2nc3ccccn3c2CN2CC3CCC(C2)N3C(=O)OC(C)(C)C)cn1

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ KCNK3 O14649 20/20 0.63
▸ KCNK9 Q9NPC2 20/20 0.63

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
SCHEMBL19807797 1.00 KCNK3 (0.63) KCNK3KCNK9
SCHEMBL19807871 0.89 KCNK3 (0.77) KCNK3KCNK9
SCHEMBL22635915 0.88 KCNK3 (0.54) KCNK3KCNK9
SCHEMBL31448490 0.86 KCNK3 (0.64) KCNK3KCNK9
SCHEMBL19807619 0.86 KCNK3 (0.64) KCNK3KCNK9
SCHEMBL19807870 0.85 KCNK3 (0.77) KCNK3KCNK9
SCHEMBL19807864 0.85 KCNK3 (0.77) KCNK3KCNK9
SCHEMBL19807867 0.84 KCNK3 (0.77) KCNK3KCNK9
SCHEMBL19807628 0.81 KCNK3 (0.64) KCNK3KCNK9
SCHEMBL31020924 0.81 KCNK3 (0.64) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3487856-B1 SUBSTITUTED DIAZAHETERO-BICYCLIC COMPOUNDS AND THEIR USE BAYER AG (DE) 2025-01-22 — — EP disclosed
CN-118785904-A Conjugates of TASK1/3 channel blockers and P2X3 receptor antagonists for the treatment of sleep apnea 拜耳公司 2024-10-15 — — CN disclosed
CN-118541153-A Conjugates of a TASK1/3 channel blocker and a norepinephrine reuptake inhibitor for the treatment of sleep apnea 拜耳公司 2024-08-23 — — CN disclosed
CN-118434415-A Conjugates of TASK1/3 channel blockers and muscarinic receptor antagonists for the treatment of sleep apnea 拜耳公司 2024-08-02 — — CN disclosed
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