SCHEMBL28534706

SCHEMBL28534706

CCOOC(=O)C(C)=CCC1CO1

nearest known ligand 0.37

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL1809474 0.83 ALDH1A1 (0.42) ALDH1A1
SCHEMBL27708634 0.81 ALDH1A1 (0.42) ALDH1A1
SCHEMBL950903 0.80 ALDH1A1 (0.41) ALDH1A1
SCHEMBL9245577 0.80 ALDH1A1 (0.41) ALDH1A1
SCHEMBL933216 0.80 ALDH1A1 (0.41) ALDH1A1
SCHEMBL28977133 0.78 ALDH1A1 (0.40) ALDH1A1
SCHEMBL28304075 0.78 ALDH1A1 (0.40) ALDH1A1
SCHEMBL5031593 0.78 ALDH1A1 (0.43) ALDH1A1
SCHEMBL4370786 0.78 ALDH1A1 (0.43) ALDH1A1
SCHEMBL7213623 0.77 ALDH1A1 (0.40) 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
CN-108143634-B Dental root surface protection material composition 北京安泰生物医用材料有限公司 2021-02-19 CN claimed
CN-108143634-B Dental root surface protection material composition 北京安泰生物医用材料有限公司 2021-02-19 CN disclosed