SCHEMBL7033348

SCHEMBL7033348

CC(C1=C(CCO)[CH]c2ccccc21)C1=C(CCO)[CH]c2ccccc21

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL6912951 0.80 NPC1 (0.32)
SCHEMBL5597075 0.71 CDC25A (0.35) TDP1
SCHEMBL7005323 0.70 CDC25B (0.37) TDP1
SCHEMBL5688926 0.62 CDC25B (0.43) TDP1
SCHEMBL3899597 0.62 CDC25A (0.37)
SCHEMBL2872380 0.59 SETD7 (0.31)
SCHEMBL9120704 0.59
SCHEMBL9376982 0.59 TDP1 (0.41) TDP1
SCHEMBL8857807 0.58 CDC25A (0.34)
SCHEMBL2863610 0.58 FGFR1 (0.34)

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-20030144135-A1 PREPARATION AND USE OF HETEROGENEOUS CATALYST COMPONENTS FOR OLEFINS POLYMERIZATION REPSOL QUIMICA S.A. (ES) 2003-07-31 US disclosed