SCHEMBL8566874

SCHEMBL8566874

CCC[N]N(CCO)CCO

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.35
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL1793940 0.80 CA12 (0.33)
SCHEMBL1704328 0.76 CA12 (0.36) ALDH1A1
SCHEMBL9421748 0.74 DNM1 (0.42)
SCHEMBL6973884 0.72 CA12 (0.33)
SCHEMBL838600 0.71
SCHEMBL6973642 0.67 CA12 (0.35)
Trolamine SCHEMBL11800024 0.64 MAPT (0.47) MAPTALDH1A1
N-Ethyl-N-(2-Hydroxyethyl)Nitrosamine SCHEMBL6304339 0.63
Trolamine SCHEMBL29234087 0.61 MAPT (0.44) MAPTALDH1A1
SCHEMBL17035376 0.59 MAPT (0.42) MAPTALDH1A1

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
US-5763438-A ANTIVIRAL AGENTS SEIKAGAKU CORPORATION (JP) 1998-06-09 US claimed