SCHEMBL28949580

SCHEMBL28949580

CC1CC2CCCC[C@H]2C(C)(O)C1(C)C

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.33
ALDH1A1 P00352 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MAPT P10636 1/20 0.31

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
SCHEMBL17629689 0.84 HSD17B10 (0.33) HSD17B10ALDH1A1L3MBTL1MAPT
SCHEMBL7254445 0.81 ALDH1A1 (0.30) ALDH1A1
SCHEMBL9694865 0.74 ALDH1A1 (0.32) ALDH1A1
SCHEMBL11500284 0.73
SCHEMBL29093778 0.71
Furan SCHEMBL28845560 0.69
SCHEMBL14880001 0.68 ALDH1A1 (0.38) HSD17B10ALDH1A1L3MBTL1
SCHEMBL28353708 0.67 ALDH1A1 (0.33) HSD17B10ALDH1A1L3MBTL1MAPT
SCHEMBL7166742 0.64 CA1 (0.33) HSD17B10
SCHEMBL20528809 0.63 ALDH1A1 (0.37) HSD17B10ALDH1A1L3MBTL1MAPT

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-115698247-A Soap composition 弗门尼舍有限公司 2023-02-03 CN claimed
CN-115698247-A Soap composition 弗门尼舍有限公司 2023-02-03 CN disclosed