Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL6606007

CCOC(=O)C(Cl)c1ncc(C(F)(F)F)cc1Cl.N

nearest known ligand 0.67

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.67
MEN1 O00255 5/20 0.67
MAPK1 P28482 1/20 0.64
RECQL P46063 2/20 0.58
CYP1A2 P05177 1/20 0.58
CYP3A4 P08684 1/20 0.58
CYP2C19 P33261 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.55
ALDH1A1 P00352 2/20 0.54
HPGD P15428 1/20 0.53
GAA P10253 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
KDM4E B2RXH2 2/20 0.47
LMNA P02545 2/20 0.47
POLB P06746 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
SCHEMBL5211782 0.87 KMT2A (0.82) KMT2AMEN1MAPK1RECQLCYP1A2
SCHEMBL29649689 0.87 KMT2A (0.82) KMT2AMEN1MAPK1RECQLCYP1A2
SCHEMBL4380392 0.85 KMT2A (0.67) KMT2AMEN1MAPK1RECQLCYP1A2
SCHEMBL637918 0.85 KMT2A (0.67) KMT2AMEN1MAPK1RECQLCYP1A2
Hydrochloric Acid SCHEMBL636048 0.84 KMT2A (0.66) KMT2AMEN1MAPK1RECQLCYP1A2
SCHEMBL2891610 0.84 KMT2A (0.77) KMT2AMEN1MAPK1RECQLCYP1A2
SCHEMBL19371259 0.81 KMT2A (0.64) KMT2AMEN1MAPK1RECQLCYP1A2
SCHEMBL20333511 0.79 MAPK1 (1.00) KMT2AMEN1MAPK1RECQLCYP1A2
SCHEMBL784211 0.78 MAPK1 (0.81) KMT2AMEN1MAPK1RECQLCYP1A2
SCHEMBL29135831 0.77 MAPK1 (0.97) KMT2AMEN1MAPK1RECQLCYP1A2

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-6821992-B1 ESPECIALLY AGAINST FUNGAL DISEASES OF PLANTS, E.G. MILDEWS AND PARTICULARLY CEREAL POWDERY MILDEW (ERYSIPHE GRAMINIS) AND VINE DOWNY MILDEW (PLASMOPARA VITICOLA), RICE BLAST (PYRICULARIA ORYZAE), ETC. AVENTIS CROPSCIENCE S.A. (FR) 2004-11-23 US disclosed
EP-1204323-B1 FUNGICIDES AVENTIS CROPSCIENCE GMBH (DE) 2004-07-14 EP disclosed