SCHEMBL7765631

SCHEMBL7765631

CCCC(CCC)C(CN)C(CCC)CCC

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 1/20 0.37
ALDH1A1 P00352 2/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL7761886 0.82 ALDH1A1 (0.50) ALDH1A1TDP1
SCHEMBL7765622 0.80 OPRM1 (0.46) ALDH1A1TDP1
SCHEMBL22138552 0.78 METAP1 (0.39) METAP1ALDH1A1TDP1
SCHEMBL22400117 0.73 ALDH1A1 (0.40) METAP1ALDH1A1TDP1
SCHEMBL16111959 0.73 METAP1 (0.41) METAP1ALDH1A1TDP1
SCHEMBL5932767 0.73
SCHEMBL23656110 0.73 ALDH1A1 (0.36) METAP1ALDH1A1TDP1
SCHEMBL5473438 0.71 METAP1 (0.41) METAP1TDP1
SCHEMBL20309928 0.71
SCHEMBL13164212 0.71 METAP1 (0.38) METAP1ALDH1A1TDP1

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
WO-2001092420-A2 PERYLENE DYES WITH PERSISTENT FLUORESCENCE CAUSED BY STERIC INHIBITION OF AGGREGATION RADIANT COLOR N.V. (BE) 2001-12-06 WO disclosed