SCHEMBL31434867

SCHEMBL31434867

C=C(C)CCC(CC)CC

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.35
ALDH1A1 P00352 1/20 0.33
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 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
SCHEMBL29139850 0.87 CA2 (0.41) CA2ALDH1A1TDP1
SCHEMBL466785 0.87 ALDH1A1 (0.50) CA2ALDH1A1
SCHEMBL466806 0.85 ALDH1A1 (0.48) CA2ALDH1A1TDP1
SCHEMBL25677570 0.85 ALDH1A1 (0.48) CA2ALDH1A1TDP1
SCHEMBL30681660 0.84 ALDH1A1 (0.41) CA2ALDH1A1TDP1
SCHEMBL38664835 0.84 CA2 (0.57) CA2ALDH1A1TDP1
SCHEMBL24134109 0.82 ALDH1A1 (0.34) ALDH1A1
SCHEMBL2033702 0.82 CA2 (0.50) CA2ALDH1A1TDP1
SCHEMBL22111103 0.76 LMNA (0.45) CA2ALDH1A1
SCHEMBL23890184 0.76

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-2025047593-A1 POLYETHYLENE RESIN COMPOSITION AND FILM OF SAME リケンテクノス株式会社 2025-03-06 WO disclosed