SCHEMBL25513622

SCHEMBL25513622

C=Cc1ccccc1CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

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
SCHEMBL25513619 1.00 ALDH1A1 (0.32) ALDH1A1
SCHEMBL25513626 0.98 ALDH1A1 (0.32) ALDH1A1
SCHEMBL7792768 0.82 ALDH1A1 (0.34) ALDH1A1
SCHEMBL8624261 0.80
SCHEMBL7791503 0.77 ALDH1A1 (0.35) ALDH1A1
SCHEMBL28991325 0.77 ALDH1A1 (0.35) ALDH1A1
SCHEMBL595200 0.73 ALDH1A1 (0.48) ALDH1A1
SCHEMBL29377653 0.73 ALDH1A1 (0.48) ALDH1A1
SCHEMBL5130782 0.73 RIPK1 (0.39) ALDH1A1
SCHEMBL7154299 0.72 TAAR1 (0.31)

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
WO-2023085800-A1 COMPOUND, METHOD FOR PREPARING SAME, AND SINGLE MOLECULE AND POLYMER DERIVED FROM SAME 주식회사 엘지화학 2023-05-19 WO disclosed