SCHEMBL20567945

SCHEMBL20567945

C=Cc1ccccc1C[PH](CCCO)(CCCO)CCCO

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL2344700 0.83 ALDH1A1 (0.33) ALDH1A1
Phosphine SCHEMBL8143769 0.82 ALDH1A1 (0.32) ALDH1A1
SCHEMBL2346267 0.81 THRA (0.37) ALDH1A1
SCHEMBL4840342 0.81 THRA (0.37) ALDH1A1
SCHEMBL4835886 0.81 THRA (0.37) ALDH1A1
SCHEMBL8273301 0.77 ALDH1A1 (0.39) ALDH1A1
SCHEMBL5501020 0.75 ALDH1A1 (0.38) ALDH1A1
SCHEMBL8019676 0.75 ALDH1A1 (0.38) ALDH1A1
SCHEMBL3696634 0.75 ALDH1A1 (0.38) ALDH1A1
SCHEMBL7768640 0.73 ALDH1A1 (0.33) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018213939-A1 EFFECTIVE ANTIBACTERIAL HYDROPHILIC PHOSPHONIUM POLYMERS WITH LOW HEMOLYTIC ACTIVITY THE UNIVERSITY OF WESTERN ONTARIO (CA) 2018-11-29 WO disclosed