SCHEMBL22124333

SCHEMBL22124333

OCCCCOC1CCC1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.39
NAAA Q02083 1/20 0.33
SPHK1 Q9NYA1 1/20 0.31
GAA P10253 1/20 0.31

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
SCHEMBL3752919 0.95 NPC1 (0.43) NPC1NAAASPHK1GAA
SCHEMBL1258617 0.93 NPC1 (0.47) NPC1NAAASPHK1
SCHEMBL21244129 0.91 NPC1 (0.32) NPC1
SCHEMBL1901243 0.91 NPC1 (0.45) NPC1NAAASPHK1GAA
SCHEMBL8614030 0.91 NPC1 (0.45) NPC1NAAASPHK1GAA
SCHEMBL3098673 0.90
SCHEMBL10679303 0.90 EPHX2 (0.33) NPC1SPHK1GAA
SCHEMBL10684492 0.88 GAA (0.35) NPC1SPHK1GAA
SCHEMBL10687104 0.88 GAA (0.35) NPC1SPHK1GAA
SCHEMBL13096848 0.88 GAA (0.35) NPC1SPHK1GAA

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-3898633-A1 SUBSTITUTED OXOPYRIDINE DERIVATIVES Bayer Aktiengesellschaft (DE) 2021-10-27 EP disclosed
CN-113474348-A Substituted oxopyridine derivatives 拜耳公司 2021-10-01 CN disclosed
WO-2020127504-A1 SUBSTITUTED OXOPYRIDINE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2020-06-25 WO disclosed
WO-2020127504-A1 SUBSTITUTED OXOPYRIDINE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2020-06-25 WO disclosed