SCHEMBL28461985

SCHEMBL28461985

CC(C)(O)CCCOOCCCC(C)(C)O

nearest known ligand 0.50

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.50

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
SCHEMBL3044735 0.82 ALDH1A1 (0.50) ALDH1A1
SCHEMBL1394318 0.80
SCHEMBL6257222 0.80 ALDH1A1 (0.47) ALDH1A1
SCHEMBL10192140 0.78 ALDH1A1 (0.45) ALDH1A1
SCHEMBL30301786 0.78 ALDH1A1 (0.35) ALDH1A1
SCHEMBL2818804 0.77 ALDH1A1 (0.69) ALDH1A1
SCHEMBL1269985 0.77 ALDH1A1 (0.69) ALDH1A1
SCHEMBL18028838 0.76 ALDH1A1 (0.43) ALDH1A1
SCHEMBL8027504 0.75 HRH3 (0.34)
SCHEMBL3035015 0.74 ALDH1A1 (0.47) 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-111630073-B Vinyl chloride polymer and process for producing the same 株式会社LG化学 2022-05-06 CN disclosed
CN-111630073-A Vinyl chloride polymer and method for preparing the same 株式会社LG化学 2020-09-04 CN disclosed