SCHEMBL30417783

SCHEMBL30417783

CCCCCNC(=O)N1C2CCC1(C)CNC2

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GNAI3 P08754 1/20 0.40
▸ GNAO1 P09471 1/20 0.40
▸ GNAI1 P63096 1/20 0.40
▸ EPHX1 P07099 9/20 0.39
▸ PRCP P42785 2/20 0.39
▸ EPHX2 P34913 2/20 0.37
▸ NAAA Q02083 1/20 0.37
▸ NAMPT P43490 2/20 0.36

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
SCHEMBL30359136 0.75 GNAI3 (0.48) GNAI3GNAO1GNAI1EPHX1PRCP
SCHEMBL25242456 0.73 — —
SCHEMBL22636087 0.71 — —
SCHEMBL11708053 0.68 NAMPT (0.51) EPHX1PRCPNAMPT
SCHEMBL30998613 0.66 CHRM2 (0.39) EPHX1
SCHEMBL11126773 0.66 EPHX2 (0.41) GNAI3GNAO1GNAI1EPHX1PRCP
SCHEMBL22635907 0.66 GNAI3 (0.31) GNAI3GNAO1GNAI1
SCHEMBL3241059 0.64 L3MBTL1 (0.39) GNAI3GNAO1GNAI1EPHX1PRCP
SCHEMBL23123873 0.63 HTT (0.40) GNAI3GNAO1GNAI1EPHX1PRCP
SCHEMBL5506026 0.62 HTT (0.57) GNAI3GNAO1GNAI1EPHX1PRCP

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 3 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
EP-4452263-A1 COMBINATION OF A TASK1/3 CHANNEL BLOCKER WITH A P2X3 RECEPTOR ANTAGONIST 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
Send feedback