SCHEMBL22329007

SCHEMBL22329007

O=C1OCC(COC/C=C/S)O1

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
SCHEMBL20869684 0.90 ALDH1A1 (0.37) ALDH1A1
SCHEMBL8051039 0.80 TSHR (0.33) ALDH1A1
SCHEMBL892666 0.80 ALDH1A1 (0.56) ALDH1A1
SCHEMBL22329014 0.79 TSHR (0.36) ALDH1A1
SCHEMBL6553153 0.77 TSHR (0.40) ALDH1A1
SCHEMBL13003973 0.77 TSHR (0.31)
SCHEMBL29032099 0.75 ALDH1A1 (0.31) ALDH1A1
SCHEMBL17461572 0.75 TSHR (0.39) ALDH1A1
SCHEMBL17085419 0.75 ALDH1A1 (0.31) ALDH1A1
SCHEMBL16675416 0.74 TSHR (0.52) 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
US-20200255571-A1 LIQUID HYDROCARBON COPOLYMERS HAVING TWO CYCLOCARBONATE ETHER END GROUPS BOSTIK SA (FR) 2020-08-13 US disclosed