SCHEMBL7919640

SCHEMBL7919640

C[CH]COC(C)COCCOC(C)C

nearest known ligand 0.37

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL3617286 0.84 TDP1 (0.37) TDP1
SCHEMBL2757540 0.83 TDP1 (0.45) TDP1
SCHEMBL4885262 0.82 TDP1 (0.57) TDP1
SCHEMBL898861 0.81 TDP1 (0.34) TDP1
SCHEMBL4895019 0.81
SCHEMBL924214 0.79 TDP1 (0.34) TDP1
SCHEMBL4884865 0.79
SCHEMBL4891276 0.78 TDP1 (0.44) TDP1
SCHEMBL4891663 0.78 TDP1 (0.58) TDP1
SCHEMBL6936672 0.77 TDP1 (0.43) TDP1

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-6217793-B1 Acetylene compound, liquid crystal composition and liquid crystal element MITSUI CHEMICALS, INC. (JP) 2001-04-17 US disclosed