SCHEMBL6567348

SCHEMBL6567348

CCCC(O)CCCC(C)(C)O

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
ACACB O00763 1/20 0.41
ACACA Q13085 1/20 0.41
NFKB1 P19838 1/20 0.39
FFAR4 Q5NUL3 1/20 0.36
FFAR1 O14842 1/20 0.36
GPR84 Q9NQS5 5/20 0.34
FDPS P14324 1/20 0.31
PSEN1 P49768 1/20 0.30
PSEN2 P49810 1/20 0.30
APH1B Q8WW43 1/20 0.30
NCSTN Q92542 1/20 0.30
APH1A Q96BI3 1/20 0.30
PSENEN Q9NZ42 1/20 0.30
FAAH O00519 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
SCHEMBL7787347 0.88 ALDH1A1 (0.43) ALDH1A1ACACBACACANFKB1FDPS
SCHEMBL6182308 0.87 ALDH1A1 (0.47) ALDH1A1ACACBACACANFKB1FFAR4
SCHEMBL10264066 0.85 ACACB (0.54) ALDH1A1ACACBACACANFKB1FFAR4
SCHEMBL16074714 0.84 NFKB1 (0.42) ALDH1A1ACACBACACANFKB1FFAR4
SCHEMBL11264800 0.83 ALDH1A1 (0.43) ALDH1A1ACACBACACANFKB1GPR84
SCHEMBL10264067 0.83 ACACB (0.57) ALDH1A1ACACBACACANFKB1FFAR4
SCHEMBL16074897 0.82 NFKB1 (0.50) ALDH1A1ACACBACACANFKB1FFAR4
SCHEMBL16074913 0.80 FFAR1 (0.50) ACACBACACANFKB1FFAR4FFAR1
SCHEMBL16074941 0.80 FFAR1 (0.50) ACACBACACANFKB1FFAR4FFAR1
SCHEMBL10898459 0.80 FFAR1 (0.50) ACACBACACANFKB1FFAR4FFAR1

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-1404767-A1 SOLVENT-CONTAINING MIXTURES WHICH CAN BE CURED PHYSICALLY OR THERMALLY AND/ OR BY MEANS OF ACTINIC RADIATION. METHOD FOR PRODUCTION AND USE THEREOF BASF Coatings AG (DE) 2004-04-07 EP claimed
WO-2003000809-A1 SOLVENT-CONTAINING MIXTURES WHICH CAN BE CURED PHYSICALLY OR THERMALLY AND/ OR BY MEANS OF ACTINIC RADIATION. METHOD FOR PRODUCTION AND USE THEREOF BASF COATINGS AG (DE) 2003-01-03 WO claimed