SCHEMBL28577101

SCHEMBL28577101

CCCCOC(=O)CCCc1ccc(OC)cc1

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.57
F2RL1 P55085 1/20 0.51
ALDH1A1 P00352 2/20 0.50
CALM1 P0DP23 1/20 0.50
DGKA P23743 1/20 0.50
TDP1 Q9NUW8 1/20 0.49

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
SCHEMBL31329309 0.96 DGKA (0.54) ALOX5DGKA
SCHEMBL15164336 0.91 ALOX5 (0.60) ALOX5F2RL1ALDH1A1CALM1
SCHEMBL27622137 0.88 P2RY10 (0.54) F2RL1ALDH1A1DGKATDP1
SCHEMBL1239542 0.88 ALOX5 (0.65) ALOX5F2RL1ALDH1A1CALM1
SCHEMBL8867697 0.87 ALOX5 (0.54) ALOX5F2RL1ALDH1A1CALM1TDP1
SCHEMBL14595169 0.85 LMNA (0.56) ALDH1A1DGKATDP1
SCHEMBL27919371 0.85 DGKA (0.50) ALOX5ALDH1A1DGKATDP1
SCHEMBL28262489 0.85 MTNR1A (0.54)
SCHEMBL15164335 0.85 ALOX5 (0.51) ALOX5F2RL1ALDH1A1
SCHEMBL22518642 0.84 TDP1 (0.64) ALOX5ALDH1A1DGKATDP1

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-109096420-B Catalyst for olefin polymerization and olefin polymerization method 中国石油化工股份有限公司 2021-05-11 CN disclosed