SCHEMBL26430859

SCHEMBL26430859

CC(C)(O)CCOC(C)(C)CCCC(C)(C)OCCC(C)(C)O

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43
CA2 P00918 1/20 0.31

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
SCHEMBL20762695 0.87 ALDH1A1 (0.36) ALDH1A1
SCHEMBL22902796 0.85 SMPD1 (0.39) ALDH1A1
SCHEMBL22903033 0.85 SMPD1 (0.39) ALDH1A1
SCHEMBL18948021 0.85 SMPD1 (0.39) ALDH1A1
SCHEMBL18947975 0.85 SMPD1 (0.39) ALDH1A1
SCHEMBL24030724 0.85 SMPD1 (0.39) ALDH1A1
SCHEMBL20684254 0.85 SMPD1 (0.39) ALDH1A1
SCHEMBL19039340 0.85 SMPD1 (0.39) ALDH1A1
SCHEMBL20077811 0.85 SMPD1 (0.39) ALDH1A1
SCHEMBL19650727 0.84 CA2 (0.33) ALDH1A1CA2

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-11639412-B2 Acute care cover for severe injuries THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2023-05-02 US disclosed