SCHEMBL28073281

SCHEMBL28073281

COC(=O)CBr.COC(=O)CCl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.43
TRPA1 O75762 2/20 0.42
ALDH1A1 P00352 2/20 0.42
HSD17B10 Q99714 2/20 0.40
MGAM O43451 1/20 0.40
GAA P10253 1/20 0.40
SI P14410 1/20 0.40
MGAM2 Q2M2H8 1/20 0.40
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 3/20 0.37
CA12 O43570 2/20 0.37
CA14 Q9ULX7 2/20 0.37
CYP2C19 P33261 1/20 0.37
KDM4E B2RXH2 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.35
TET2 Q6N021 1/20 0.33
TP53 P04637 1/20 0.33
RECQL P46063 1/20 0.32
MAPT P10636 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
Hydrochloric Acid SCHEMBL28882431 0.89
SCHEMBL12305774 0.87
SCHEMBL12305750 0.87
SCHEMBL26568 0.87
SCHEMBL140582 0.87
SCHEMBL1331006 0.87
SCHEMBL8926646 0.84
Methane SCHEMBL27731346 0.84
Bromomethane SCHEMBL27965557 0.84
SCHEMBL27618796 0.84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105985286-A Pyridone azo compound, N-substituted pyridone-based pyridine quaternary ammonium salt intermediate thereof, and preparation methods thereof 上海申伦科技发展有限公司 2016-10-05 CN claimed
CN-105985285-A Pyridone azo compound and preparation method thereof 上海申伦科技发展有限公司 2016-10-05 CN claimed
CN-106397482-A Synthetic method for trimethyl phosphonoacetate 江西盛伟科技股份有限公司 2017-02-15 CN disclosed
CN-105985286-A Pyridone azo compound, N-substituted pyridone-based pyridine quaternary ammonium salt intermediate thereof, and preparation methods thereof 上海申伦科技发展有限公司 2016-10-05 CN disclosed
CN-105985285-A Pyridone azo compound and preparation method thereof 上海申伦科技发展有限公司 2016-10-05 CN disclosed