Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL10464530

C=C(C)C(OC(=O)COc1ccc(Cl)cc1Cl)C(=O)O.N

nearest known ligand 0.58

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Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.55
MAPT P10636 2/20 0.54
TSHR P16473 1/20 0.53
ALDH1A1 P00352 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.50
RECQL P46063 1/20 0.49
MAPK1 P28482 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
PPARD Q03181 1/20 0.46
LMNA P02545 1/20 0.46

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
SCHEMBL10464484 0.99 TDP1 (0.56) TDP1MAPTTSHRALDH1A1L3MBTL1
SCHEMBL10461462 0.88 MAPT (0.54) TDP1MAPTTSHRALDH1A1L3MBTL1
SCHEMBL10462798 0.87 MAPT (0.53) TDP1MAPTTSHRALDH1A1L3MBTL1
SCHEMBL10464447 0.86 TDP1 (0.55) TDP1MAPTTSHRALDH1A1L3MBTL1
Ammonia Solution, Strong SCHEMBL29010268 0.80 MAPT (0.65) TDP1MAPTTSHRALDH1A1L3MBTL1
SCHEMBL10462804 0.80 MEN1 (0.51) TDP1MAPTTSHRALDH1A1L3MBTL1
SCHEMBL10463975 0.80 TDP1 (0.64) TDP1MAPTTSHRALDH1A1L3MBTL1
SCHEMBL29860787 0.79 MAPT (0.67) TDP1MAPTTSHRALDH1A1L3MBTL1
SCHEMBL158457 0.79 MAPT (0.67) TDP1MAPTTSHRALDH1A1L3MBTL1
SCHEMBL10463466 0.79 TDP1 (0.55) TDP1MAPTTSHRALDH1A1L3MBTL1

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-4902334-A HERBICIDES TEIJIN LIMITED (JP) 1990-02-20 US disclosed
EP-0149034-A2 Regulation of plant metalbolism by alpha,beta- or beta,gamma-unsaturated carboxylic acids or derivatives thereof TEIJIN LIMITED (JP) 1985-07-24 EP disclosed