SCHEMBL28657402

SCHEMBL28657402

CC(COCC1CO1)OCC1CO1.CCCCOCC1CO1

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.69
ALDH1A1 P00352 5/20 0.60
TDP1 Q9NUW8 2/20 0.60
TSHR P16473 2/20 0.52
PDK1 Q15118 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL756282 0.90 SMN1; SMN2 (0.62) SMN1; SMN2ALDH1A1TDP1TSHRPDK1
SCHEMBL28259378 0.89 TSHR (0.50) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL40032 0.87 ALDH1A1 (0.47) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL13384514 0.85 TSHR (0.50) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL18705903 0.85 TSHR (0.50) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
Water SCHEMBL28203785 0.85 ALDH1A1 (0.46) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
Ammonia Solution, Strong SCHEMBL28794546 0.85 ALDH1A1 (0.46) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL27722135 0.85 ALDH1A1 (0.46) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL19820320 0.84 SMN1; SMN2 (0.68) SMN1; SMN2ALDH1A1TDP1TSHRPDK1
SCHEMBL19410597 0.83 ALDH1A1 (0.45) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1

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-113305956-B Wood modifier composition and method for improving physical and mechanical properties of wood 中国林业科学研究院木材工业研究所 2022-07-08 CN disclosed
CN-113305956-A Wood modifier composition and method for improving physical and mechanical properties of wood 中国林业科学研究院木材工业研究所 2021-08-27 CN disclosed