SCHEMBL7861908

SCHEMBL7861908

CCONC(=N)NC(=N)N(OCC)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ADRA2A P08913 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33

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
SCHEMBL19745321 0.73 MEN1 (0.30) MEN1KMT2A
SCHEMBL6692879 0.72 MEN1 (0.38) MEN1KMT2A
SCHEMBL8395773 0.72 ALDH1A1 (0.39) MEN1KMT2A
SCHEMBL8392178 0.72 ALDH1A1 (0.44) MEN1KMT2A
SCHEMBL5177934 0.69 MEN1 (0.37) MEN1KMT2A
SCHEMBL8395777 0.68 ALDH1A1 (0.48) MEN1KMT2A
SCHEMBL5510643 0.68 ALDH1A1 (0.44) MEN1KMT2A
SCHEMBL25336401 0.68 ALDH1A1 (0.47) MEN1KMT2A
SCHEMBL5512049 0.68 ALDH1A1 (0.47) MEN1KMT2A
SCHEMBL13603966 0.66 ALDH1A1 (0.46) MEN1KMT2A

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
EP-1075560-A1 WRINKLE AND MALODOUR REDUCING COMPOSITION The Procter & Gamble Company (US) 2001-02-14 EP disclosed
WO-1999055951-A1 WRINKLE AND MALODOUR REDUCING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1999-11-04 WO disclosed