SCHEMBL10051172

SCHEMBL10051172

CC(C)C(CC(C)(C)C)C(=O)OCCCCO

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.37
CYP4A11 Q02928 3/20 0.37
ACHE P22303 6/20 0.36
TDP1 Q9NUW8 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
SCHEMBL13174627 0.87 ALDH1A1 (0.33) ACHE
SCHEMBL16182029 0.85 NAAA (0.46) ACHE
SCHEMBL14409974 0.85 NAAA (0.46) ACHE
SCHEMBL24136103 0.84 ALDH1A1 (0.44) TDP1
SCHEMBL22810807 0.80 GRM1 (0.35) TDP1
SCHEMBL19272529 0.77 ACHE (0.44) CYP4F2CYP4A11ACHETDP1
SCHEMBL24022659 0.77 ACHE (0.40) CYP4F2CYP4A11ACHETDP1
SCHEMBL28342758 0.77 NAAA (0.47)
SCHEMBL23861518 0.76
SCHEMBL18015886 0.76

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-2413168-A1 Birefringence pattern builder Fujifilm Corporation (JP) 2012-02-01 EP disclosed