Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL6506701

Fc1ccc2c(c1)OC2.N

nearest known ligand 0.41

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Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.41
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
GAA P10253 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
PDE3A Q14432 1/20 0.37
NR3C2 P08235 5/20 0.37
MAPK14 Q16539 6/20 0.36
RIPK1 Q13546 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
HTR2B P41595 1/20 0.35
THRB P10828 1/20 0.35

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 SCHEMBL10839310 0.98 NOTUM (0.40) NOTUMKDM4EALDH1A1GAAL3MBTL1
SCHEMBL30338444 0.81 APEX1 (0.34) NOTUMKDM4EALDH1A1GAAL3MBTL1
SCHEMBL28020004 0.78 NR3C2 (0.39) NOTUMKDM4EALDH1A1GAAL3MBTL1
SCHEMBL8342110 0.76 MAPT (0.43) KDM4EALDH1A1L3MBTL1RIPK1
SCHEMBL30410306 0.76 MAPT (0.43) KDM4EALDH1A1L3MBTL1RIPK1
SCHEMBL10555531 0.74 MAPK14 (0.60) NR3C2MAPK14
SCHEMBL23142218 0.74 ALDH1A1 (0.46) ALDH1A1NR3C2
SCHEMBL10446532 0.73 HTR2C (0.40) NOTUMKDM4EALDH1A1GAAL3MBTL1
SCHEMBL3644639 0.72 FABP6 (0.41) KDM4EALDH1A1L3MBTL1RIPK1
SCHEMBL30665414 0.72 FABP6 (0.41) KDM4EALDH1A1L3MBTL1RIPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005040127-A1 NOVEL COMPOUNDS AS AGONIST FOR PPAR GAMMA AND PPAR ALPHA, METHOD FOR PREPARATION OF THE SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME LG LIFE SCIENCES LTD. (KR) 2005-05-06 WO disclosed