SCHEMBL14367114

SCHEMBL14367114

C=C(C)C(=O)OC[N+](=O)[O-]

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.48
THRB P10828 1/20 0.45
ALDH1A1 P00352 2/20 0.42
TDP1 Q9NUW8 2/20 0.33
POLB P06746 1/20 0.33
APEX1 P27695 1/20 0.33
HTT P42858 1/20 0.33
CPA1 P15085 1/20 0.31
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
BLM P54132 1/20 0.30
HBB P68871 1/20 0.30
KMT2A Q03164 1/20 0.30
HIF1A Q16665 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
SCHEMBL2036250 0.81 THRB (0.50) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL6247833 0.78
SCHEMBL27901752 0.78 TSHR (0.55) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL15194349 0.77 THRB (0.50) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL28975645 0.76
SCHEMBL19371485 0.75 TSHR (0.42) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL1262355 0.75 TSHR (0.42) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL15798107 0.75 TSHR (0.42) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL8840207 0.74 TSHR (0.60) TSHRTHRBALDH1A1
SCHEMBL19371493 0.74 TSHR (0.41) TSHRTHRBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101373346-B Electrostatic image developing toner, electrostatic image developer, toner cartridge, process cartridge and image forming apparatus FUJI XEROX CO LTD 2012-06-27 CN disclosed
CN-101373346-A Electrostatic image developing toner, electrostatic image developer, toner cartridge, process cartridge and image forming apparatus FUJI XEROX CO LTD (JP) 2009-02-25 CN disclosed
US-7288360-B2 Image recording material FUJIFILM CORPORATION (JP) 2007-10-30 US disclosed