SCHEMBL28967290

SCHEMBL28967290

C=C(C)C(=O)NC(CCC)(C(C)(C)C)S(=O)(=O)O

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
TGFBR1 P36897 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
SCHEMBL28400877 0.77 ZDHHC20 (0.38) ALDH1A1
SCHEMBL2554846 0.74 ALDH1A1 (0.32) ALDH1A1TGFBR1
SCHEMBL16585437 0.74 EPHX1 (0.32) ALDH1A1TGFBR1
SCHEMBL6232119 0.73 ALDH1A1 (0.52) ALDH1A1TGFBR1
SCHEMBL16585234 0.73 MEN1 (0.35) ALDH1A1
SCHEMBL2723029 0.73 TGFBR1 (0.33) ALDH1A1TGFBR1
SCHEMBL3951646 0.73 TGFBR1 (0.34) TGFBR1
SCHEMBL16585309 0.72 MEN1 (0.37)
SCHEMBL16585142 0.72 MEN1 (0.37)
SCHEMBL16585306 0.72 MEN1 (0.37)

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-115461385-A Aqueous polymer dispersions 巴斯夫欧洲公司 2022-12-09 CN disclosed