SCHEMBL9944697

SCHEMBL9944697

CC(N)CN1CCN(CC(C)CN)CC1

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
PIK3CD O00329 1/20 0.32

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
SCHEMBL3841536 0.91
SCHEMBL9944693 0.91 PIK3CD (0.37) ALDH1A1PIK3CD
SCHEMBL6680924 0.85
SCHEMBL1043849 0.85 PIK3CD (0.39) ALDH1A1PIK3CD
SCHEMBL3917497 0.81 KMT2A (0.42) ALDH1A1
SCHEMBL21778028 0.81 KMT2A (0.42) ALDH1A1
SCHEMBL13931 0.81 KMT2A (0.42) ALDH1A1
SCHEMBL11371442 0.80 ALOX15 (0.56) ALDH1A1PIK3CD
SCHEMBL5586143 0.79 KMT2A (0.46) ALDH1A1
SCHEMBL1306075 0.79 KMT2A (0.46) ALDH1A1

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-20120145001-A1 Process For Reducing Contaminants In An Industrial Fluid Stream PCS FERGUSON, INC. 2012-06-14 US disclosed
US-20120145001-A1 Process For Reducing Contaminants In An Industrial Fluid Stream PCS FERGUSON, INC. 2012-06-14 US disclosed