Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL9422751

CCCCC(Cn1cncn1)c1ccc(Cl)cc1.N

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 3/20 0.42
KMT2A Q03164 4/20 0.41
MEN1 O00255 1/20 0.41
HTT P42858 2/20 0.41
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.41
ALDH1A1 P00352 2/20 0.41
CYP3A4 P08684 2/20 0.41
LMNA P02545 1/20 0.39
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL9198943 0.87 KMT2A (0.47) CYP19A1KMT2AMEN1HTTKDM4E
SCHEMBL7517176 0.87 ALDH1A1 (0.40) CYP19A1KMT2AMEN1HTTKDM4E
SCHEMBL9480487 0.86 NPSR1 (0.42) CYP19A1KMT2AMEN1ALDH1A1CYP3A4
SCHEMBL10970720 0.84 CYP19A1 (0.53) CYP19A1KMT2AMEN1HTTKDM4E
SCHEMBL9480900 0.81 CYP3A4 (0.40) CYP19A1KMT2AMEN1POLBALDH1A1
SCHEMBL9480234 0.80 TSHR (0.46) CYP19A1KMT2AMEN1KDM4EPOLB
SCHEMBL9482419 0.80 KMT2A (0.42) CYP19A1KMT2AMEN1HTTALDH1A1
Hydrochloric Acid SCHEMBL10832295 0.80 ALDH1A1 (0.47) CYP19A1KMT2AMEN1HTTKDM4E
SCHEMBL9711370 0.79 CYP19A1 (0.47) CYP19A1KMT2AMEN1HTTKDM4E
Hydrochloric Acid SCHEMBL9481865 0.79 KMT2A (0.41) CYP19A1KMT2AMEN1HTTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0575122-A2 Fungicidal (2-aryl-2-substituted) ethyl-1,2,4-triazoles ROHM AND HAAS COMPANY (US) 1993-12-22 EP claimed
US-5252594-A Broad spectrum, systemic ROHM AND HAAS COMPANY (US) 1993-10-12 US claimed
JP-6107643-A None JP disclosed
US-5364870-A For plants ROHM AND HAAS COMPANY (US) 1994-11-15 US disclosed
JP-H06107643-A FUNGICIDAL (2-ARYL-2-SUBSTITUTED)ETHYL-1,2,4-TRIAZOLE COMPOUND ROHM & HAAS CO 1994-04-19 JP disclosed
EP-0575122-A2 Fungicidal (2-aryl-2-substituted) ethyl-1,2,4-triazoles ROHM AND HAAS COMPANY (US) 1993-12-22 EP disclosed
US-5252594-A Broad spectrum, systemic ROHM AND HAAS COMPANY (US) 1993-10-12 US disclosed