SCHEMBL12964271

SCHEMBL12964271

CCOC(C)[N+]1(C)CCOCC1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
CDC25A P30304 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
SCHEMBL4898410 0.79 ALDH1A1 (0.30)
SCHEMBL1223459 0.76
SCHEMBL3304964 0.69 APOBEC3A (0.37) CDC25A
SCHEMBL12014172 0.69
Bromide SCHEMBL10379917 0.68 CDC25A (0.35) CDC25A
Dioxane SCHEMBL7672675 0.67 LMNA (0.67) LMNA
SCHEMBL3299954 0.66 PABPC1 (0.38) CDC25A
SCHEMBL3306169 0.65 LMNA (0.42) LMNA
SCHEMBL3305843 0.64 CTDSP1 (0.37)
Water SCHEMBL11438442 0.64

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1975208-B1 Underwater antifouling coating composition and underwater structures SHINETSU CHEMICAL CO (JP) 2012-10-03 EP disclosed
EP-1975208-A2 Underwater antifouling coating composition and underwater structures Shin-Etsu Chemical Co., Ltd. (JP) 2008-10-01 EP disclosed