SCHEMBL15470786

SCHEMBL15470786

COc1cc(OC)c2cc(COC(=O)CCC(=O)OC(C)COCC(C)OC(=O)CCC(=O)OCc3cc4c(OC)cc(OC)cc4c4c3C=CC(c3ccccc3)(c3ccc(N(C)C)cc3)O4)c3c(c2c1)OC(c1ccccc1)(c1ccc(N(C)C)cc1)C=C3

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.31
MAPK1 P28482 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
SCHEMBL15470794 0.96
SCHEMBL15470789 0.92 TDP1 (0.32) TDP1MAPK1
SCHEMBL11983659 0.88 TDP1 (0.36) TDP1MAPK1
SCHEMBL7569354 0.86 TDP1 (0.35) TDP1MAPK1
SCHEMBL13659148 0.85 TDP1 (0.30) TDP1MAPK1
SCHEMBL7568918 0.85 ALDH1A1 (0.40) TDP1MAPK1
SCHEMBL12588656 0.84
SCHEMBL12952370 0.83 TDP1 (0.33) TDP1MAPK1
SCHEMBL12588670 0.82
SCHEMBL7568969 0.81 PTPN1 (0.34) TDP1MAPK1

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
US-9217812-B2 Photochromic polymer VIVIMED LABS EUROPE LTD (GB) 2015-12-22 US disclosed
US-20140042377-A1 Photochromic Polymer VIVIMED LABS EUROPE LTD (GB) 2014-02-13 US disclosed