SCHEMBL7091908

SCHEMBL7091908

C=CC/C(CC1CO1)=C(\C)C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 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
SCHEMBL4436552 1.00 ALDH1A1 (0.34) ALDH1A1
SCHEMBL498679 0.84 ALDH1A1 (0.37) ALDH1A1
SCHEMBL8469945 0.81 ALDH1A1 (0.32) ALDH1A1
Methacrylic Acid SCHEMBL7899282 0.81 ALDH1A1 (0.44) ALDH1A1
SCHEMBL28125358 0.80 ALDH1A1 (0.54) ALDH1A1
SCHEMBL8469948 0.79 ALDH1A1 (0.32) ALDH1A1
SCHEMBL1195843 0.79 ALDH1A1 (0.34) ALDH1A1
Methacrylic Acid SCHEMBL6432663 0.78 ALDH1A1 (0.42) ALDH1A1
SCHEMBL9868371 0.78 ALDH1A1 (0.39) ALDH1A1
SCHEMBL362181 0.78 ALDH1A1 (0.35) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030175615-A1 Photopolymerization; thermosetting resins DAICEL CHEMICAL INDUSTRIES LTD. (JP) 2003-09-18 US disclosed
EP-1172693-A1 PHOTOCURABLE RESIN COMPOSITIONS DAICEL CHEMICAL INDUSTRIES, Ltd. (JP) 2002-01-16 EP disclosed