SCHEMBL17599121

SCHEMBL17599121

CC(C)(Br)C(=O)CC(N)c1ccc(O)c(O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 9/20 0.44
BLM P54132 6/20 0.44
LMNA P02545 5/20 0.44
ADRA1A P35348 2/20 0.44
NR1I2 O75469 1/20 0.44
PTGS1 P23219 1/20 0.44
KDM4E B2RXH2 8/20 0.44
RECQL P46063 7/20 0.44
MAPT P10636 6/20 0.44
APEX1 P27695 3/20 0.44
KMT2A Q03164 2/20 0.44
TSHR P16473 2/20 0.44
NFKB1 P19838 2/20 0.44
THPO P40225 2/20 0.44
HIF1A Q16665 2/20 0.44
HSD17B10 Q99714 2/20 0.44
POLB P06746 2/20 0.44
ALOX15 P16050 1/20 0.44
MTOR P42345 1/20 0.44
MAPK1 P28482 3/20 0.43

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
SCHEMBL13395908 0.80 TDP1 (0.49) TDP1BLMLMNAADRA1ANR1I2
SCHEMBL27681258 0.78 TDP1 (0.54) TDP1BLMLMNAADRA1ANR1I2
SCHEMBL4965778 0.78 TDP1 (0.54) TDP1BLMLMNAADRA1ANR1I2
SCHEMBL8289998 0.78 TDP1 (0.54) TDP1BLMLMNAADRA1ANR1I2
SCHEMBL8493378 0.74 CA12 (0.47) TDP1BLMLMNAADRA1ANR1I2
SCHEMBL13479446 0.72 TDP1 (0.62) TDP1BLMLMNAADRA1ANR1I2
SCHEMBL11430514 0.72 TDP1 (0.62) TDP1BLMLMNAADRA1ANR1I2
SCHEMBL14303527 0.72 TDP1 (0.62) TDP1BLMLMNAADRA1ANR1I2
SCHEMBL1894928 0.72 TDP1 (0.41) TDP1BLMLMNAADRA1ANR1I2
SCHEMBL7845490 0.70 TDP1 (0.53) TDP1BLMLMNAADRA1ANR1I2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2998326-B1 NOVEL COMPOSITE MATERIAL, AND POLYMER COATING MATERIAL PRECURSOR PRODUCED USING SAME JAPAN SCIENCE & TECH AGENCY (JP) 2020-02-19 EP disclosed
US-9732249-B2 Composite material, and polymer coating material precursor produced using same JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2017-08-15 US disclosed
US-20160194513-A1 NOVEL COMPOSITE MATERIAL, AND POLYMER COATING MATERIAL PRECURSOR PRODUCED USING SAME JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2016-07-07 US disclosed
EP-2998326-A1 NOVEL COMPOSITE MATERIAL, AND POLYMER COATING MATERIAL PRECURSOR PRODUCED USING SAME Japan Science and Technology Agency (JP) 2016-03-23 EP disclosed