SCHEMBL28059702

SCHEMBL28059702

C=C(C)C(=O)OC(CCN)(CC1CO1)CC1CO1

nearest known ligand 0.47

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47

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
SCHEMBL28048427 0.86 ALDH1A1 (0.37) ALDH1A1
SCHEMBL28109298 0.76 ALDH1A1 (0.54) ALDH1A1
SCHEMBL11146383 0.76 ALDH1A1 (0.40) ALDH1A1
SCHEMBL27605411 0.72 ALDH1A1 (0.43) ALDH1A1
SCHEMBL27926853 0.72 ALDH1A1 (0.38) ALDH1A1
SCHEMBL28281730 0.68 ALDH1A1 (0.73) ALDH1A1
SCHEMBL8837703 0.67 ALDH1A1 (0.78) ALDH1A1
SCHEMBL8638992 0.67 ALDH1A1 (0.78) ALDH1A1
SCHEMBL28838119 0.66 ALDH1A1 (0.58) ALDH1A1
Glycidol SCHEMBL21494170 0.66 ALDH1A1 (0.58) 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-105722909-A Pneumatic tire 住友橡胶工业株式会社 2016-06-29 CN disclosed
CN-102604177-B Rubber combination and pneumatic tyre SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2016-03-02 CN disclosed