SCHEMBL30280451

SCHEMBL30280451

CC(=O)CCC1(C)C=CC=CC1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL6901101 0.85 APEX1 (0.30)
SCHEMBL8748298 0.76 ALDH1A1 (0.31) ALDH1A1
SCHEMBL7125966 0.76
Hydrochloric Acid SCHEMBL9297137 0.75 ALDH1A1 (0.30) ALDH1A1
SCHEMBL28293404 0.74 OPRM1 (0.35) ALDH1A1
SCHEMBL31281037 0.74
SCHEMBL3687469 0.73
SCHEMBL22417703 0.73 THRB (0.39) ALDH1A1
SCHEMBL17505116 0.73 CHRM2 (0.34)
SCHEMBL15564587 0.72

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115851313-A Method for preparing lubricating oil base oil from Fischer-Tropsch hydrocracking tail oil 国家能源集团宁夏煤业有限责任公司 2023-03-28 CN disclosed