SCHEMBL8199474

SCHEMBL8199474

OCCCC1(CCCO)CCCO1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 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
SCHEMBL8208320 0.86
SCHEMBL29094264 0.78 CYP4F2 (0.35) SIRT2
SCHEMBL7242684 0.77 GRIN2D (0.31)
SCHEMBL2743756 0.77 SIRT2 (0.31) SIRT2
SCHEMBL8791545 0.76 SIRT2 (0.44) SIRT2
SCHEMBL31327306 0.76
SCHEMBL38417 0.75
SCHEMBL3421658 0.74 ALDH1A1 (0.35) SIRT2
SCHEMBL5140463 0.74 SIRT2 (0.46) SIRT2
SCHEMBL11941303 0.74 SIRT2 (0.36) SIRT2

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
US-6130195-A TETRAHYDROFURFURYL ALCOHOL AND 3-METHOXY-3-METHYL BUTANOL. KYZEN CORPORATION (US) 2000-10-10 US disclosed