SCHEMBL6839660

SCHEMBL6839660

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

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.56
TSHR P16473 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
SCHEMBL602498 1.00 ALDH1A1 (0.56) ALDH1A1TSHR
SCHEMBL5661663 0.95 ALDH1A1 (0.50) ALDH1A1TSHR
SCHEMBL277835 0.85 ALDH1A1 (0.47) ALDH1A1
Methacrylic Acid SCHEMBL4205585 0.84 GRIK1 (0.34)
Methacrylic Acid SCHEMBL4205581 0.84 GRIK1 (0.34)
SCHEMBL29425578 0.84 ALDH1A1 (0.34) ALDH1A1
SCHEMBL892355 0.80 ALDH1A1 (0.65) ALDH1A1TSHR
SCHEMBL9329248 0.80 ALDH1A1 (0.65) ALDH1A1TSHR
SCHEMBL8161723 0.80 ALDH1A1 (0.65) ALDH1A1TSHR
SCHEMBL1172614 0.80 ALDH1A1 (0.31) 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-6762221-B1 FORMING EASILY REDISPERSIBLE POLYMER POWDERS USING SPRAY DRYING TECHNIQUE BASF AKTIENGESELLSCHAFT (DE) 2004-07-13 US claimed