SCHEMBL21348876

SCHEMBL21348876

C=C(C)C(=O)OC1(/C=C(/C)C2(OC(=O)C(=C)C)CCCCC2)CCCCC1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL24208042 0.83 ALDH1A1 (0.34) ALDH1A1
SCHEMBL21361190 0.80 ALDH1A1 (0.37) ALDH1A1
SCHEMBL47318 0.78 ALDH1A1 (0.35) ALDH1A1
SCHEMBL47316 0.78 ALDH1A1 (0.35) ALDH1A1
SCHEMBL5452005 0.76 ALDH1A1 (0.37) ALDH1A1
SCHEMBL47317 0.76 ALDH1A1 (0.37) ALDH1A1
SCHEMBL17245073 0.76 ALDH1A1 (0.39) ALDH1A1
SCHEMBL24207760 0.76 ALDH1A1 (0.39) ALDH1A1
SCHEMBL24208040 0.76 ALDH1A1 (0.33) ALDH1A1
SCHEMBL24207682 0.73 ALDH1A1 (0.34) 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-2019171957-A1 NOVEL BIFUNCTIONAL (METH)ACRYLATE COMPOUND AND POLYMER 丸善石油化学株式会社 2019-09-12 WO disclosed