SCHEMBL28087256

SCHEMBL28087256

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

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.47
MEN1 O00255 1/20 0.46
BLM P54132 1/20 0.46
HBB P68871 1/20 0.46
KMT2A Q03164 1/20 0.46
HIF1A Q16665 1/20 0.46
ALDH1A1 P00352 3/20 0.40
HTT P42858 1/20 0.36
TSHR P16473 2/20 0.36
MAPT P10636 3/20 0.36
TDP1 Q9NUW8 1/20 0.36
CPA1 P15085 1/20 0.33
HCAR2 Q8TDS4 1/20 0.33
NOTUM Q6P988 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
SCHEMBL28323658 0.81 LMNA (0.39) LMNAMEN1BLMHBBKMT2A
SCHEMBL28511337 0.78 LMNA (0.41) LMNAALDH1A1TSHRMAPTTDP1
SCHEMBL72471 0.77 LMNA (0.62) LMNAALDH1A1HTTTSHRMAPT
SCHEMBL5593734 0.76
SCHEMBL31402602 0.74 LMNA (0.60) LMNABLMALDH1A1HTTTSHR
SCHEMBL1029123 0.72 LMNA (0.48) LMNAMEN1BLMHBBKMT2A
SCHEMBL18619 0.72 LMNA (0.71) LMNAALDH1A1HTTTSHRMAPT
SCHEMBL8104259 0.72 LMNA (0.78) LMNAALDH1A1TSHRMAPT
SCHEMBL15391 0.72 LMNA (0.78) LMNAALDH1A1TSHRMAPT
Isopropyl Palmitate SCHEMBL11518425 0.72 LMNA (0.79) LMNAMEN1KMT2AHIF1AALDH1A1

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-104673413-B liquid ecological gas and preparation method thereof 许明华 2017-02-22 CN claimed
CN-106186266-A The safe and efficient processing method of isopropyl nitrate 中国人民解放军63908部队 2016-12-07 CN disclosed
CN-105923736-A Treatment method of isopropyl nitrate in water 中国人民解放军63908部队 2016-09-07 CN disclosed