SCHEMBL118098

SCHEMBL118098

CCC(C)(C)C(=O)OCCOCCOCCOCCOCCOCC(C)OCC(C)O

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.53
HSD17B10 Q99714 1/20 0.36
MAPK1 P28482 1/20 0.30

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
SCHEMBL19725745 0.88 HSD17B10 (0.47) TDP1HSD17B10MAPK1
SCHEMBL25899619 0.86 TDP1 (0.35) TDP1
SCHEMBL16520399 0.85 TDP1 (0.44) TDP1HSD17B10MAPK1
SCHEMBL25899615 0.84 TDP1 (0.34) TDP1
SCHEMBL12126256 0.83 TDP1 (0.43) TDP1MAPK1
SCHEMBL18104408 0.83 TDP1 (0.43) TDP1MAPK1
SCHEMBL801671 0.83 TDP1 (0.43) TDP1MAPK1
SCHEMBL15198878 0.82 TDP1 (0.32) TDP1
SCHEMBL14341645 0.81 HSD17B10 (0.39) TDP1HSD17B10MAPK1
SCHEMBL13998504 0.80 HMGCR (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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8733919-B2 Active energy ray-curable ink composition, inkjet recording method, and inkjet printed article FUJIFILM CORPORATION (JP) 2014-05-27 US disclosed
US-20120056930-A1 ACTIVE ENERGY RAY-CURABLE INK COMPOSITION, INKJET RECORDING METHOD, AND INKJET PRINTED ARTICLE FUJIFILM CORPORATION (JP) 2012-03-08 US disclosed