SCHEMBL5484951

SCHEMBL5484951

CC(C)OC[N+]1(C)CCCC1

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
TP53 P04637 1/20 0.31
BBOX1 O75936 1/20 0.30

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
SCHEMBL907517 0.91 KDM4E (0.32) KDM4E
Nitrous Acid SCHEMBL3446912 0.88 KDM4E (0.31) KDM4E
Cyanamide SCHEMBL5488662 0.88 KDM4E (0.31) KDM4E
Thiocyanic Acid SCHEMBL2903831 0.88 KDM4E (0.31) KDM4E
SCHEMBL907508 0.88 KDM4E (0.31) KDM4E
SCHEMBL3447904 0.88 KDM4E (0.31) KDM4E
SCHEMBL3448541 0.88 KDM4E (0.31) KDM4E
SCHEMBL2903834 0.84
Trifluoroacetic Acid SCHEMBL907503 0.80 CYP3A4 (0.36) BBOX1
SCHEMBL372404 0.76 KDM4E (0.54) KDM4ETP53BBOX1

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
EP-1840124-A1 QUATERNARY AMMONIUM SALT, ELECTROLYTE, ELECTROLYTE SOLUTION AND ELECTROCHEMICAL DEVICE Otsuka Chemical Co., Ltd. (JP) 2007-10-03 EP disclosed