SCHEMBL20868607

SCHEMBL20868607

C=CCC(=O)OC/C(OC=C)=C(\C)O

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.40
HTT P42858 1/20 0.34

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
Bicarbonate SCHEMBL28313995 0.76 GAA (0.41) ALDH1A1GAAHTT
Acetic Acid SCHEMBL28868374 0.75 HTT (0.33) ALDH1A1GAAHTT
SCHEMBL16981751 0.75 ALDH1A1 (0.40) ALDH1A1GAAHTT
Acetic Acid SCHEMBL27794459 0.74 HTT (0.33) ALDH1A1HTT
Acetic Acid SCHEMBL26105206 0.74 HTT (0.33) ALDH1A1HTT
SCHEMBL15234311 0.73 ALDH1A1 (0.44) ALDH1A1GAAHTT
SCHEMBL28061478 0.71 ALDH1A1 (0.41) ALDH1A1GAAHTT
SCHEMBL7059955 0.71 ALDH1A1 (0.41) ALDH1A1GAAHTT
Methacrylic Acid SCHEMBL7587076 0.71 HTT (0.31) HTT
Ethylene SCHEMBL28124659 0.70 ALDH1A1 (0.40) ALDH1A1GAAHTT

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-2019063945-A1 LIQUID HYDROCARBON COPOLYMERS HAVING TWO CYCLOCARBONATE ESTER END GROUPS BOSTIK SA (FR) 2019-04-04 WO disclosed