SCHEMBL8558521

SCHEMBL8558521

C=CCC(C=C)C1OCCO1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
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
SCHEMBL13997220 0.82
SCHEMBL19887776 0.78 TDP1 (0.32) TDP1
SCHEMBL16879604 0.74
SCHEMBL9659963 0.71
SCHEMBL23200435 0.70
SCHEMBL11667178 0.65
SCHEMBL6004504 0.65
SCHEMBL9659328 0.64
SCHEMBL1935475 0.62
SCHEMBL14481066 0.62 EPHX1 (0.36)

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
JP-11269235-A None JP disclosed
JP-H11269235-A POLYMER CONTAINING ACETAL GROUP AND PRODUCTION THEREOF NIPPON SHOKUBAI CO LTD 1999-10-05 JP disclosed