SCHEMBL27668239

SCHEMBL27668239

CC(C)COC(=O)c1cc(C(=O)OCC(C)C)cc(S(=O)(=O)O)c1.[MgH2]

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.46
FYN P06241 1/20 0.46
ALDH1A1 P00352 5/20 0.45
TSHR P16473 1/20 0.45
GPR35 Q9HC97 1/20 0.43
JMJD6 Q6NYC1 1/20 0.42
PLA2G1B P04054 1/20 0.40
ATG4B Q9Y4P1 1/20 0.40
RAB9A P51151 3/20 0.38
SERPINE1 P05121 1/20 0.38
CDK1 P06493 1/20 0.37
CDK2 P24941 1/20 0.37
KDM4E B2RXH2 2/20 0.37
GAA P10253 1/20 0.37
PKM P14618 1/20 0.37
KMT2A Q03164 1/20 0.37
MAPT P10636 2/20 0.36
NPC1 O15118 2/20 0.36
HTT P42858 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL6855750 0.97 LCK (0.46) LCKFYNALDH1A1TSHRGPR35
SCHEMBL6296779 0.97 LCK (0.46) LCKFYNALDH1A1TSHRGPR35
SCHEMBL28761712 0.97 LCK (0.46) LCKFYNALDH1A1TSHRGPR35
SCHEMBL27647418 0.97 LCK (0.46) LCKFYNALDH1A1TSHRGPR35
SCHEMBL28758629 0.97 LCK (0.46) LCKFYNALDH1A1TSHRGPR35
SCHEMBL27668235 0.97 LCK (0.46) LCKFYNALDH1A1TSHRGPR35
SCHEMBL13520460 0.87 LCK (0.46) LCKFYNALDH1A1GPR35SERPINE1
SCHEMBL6580266 0.84 ALDH1A1 (0.59) ALDH1A1TSHRGPR35JMJD6PLA2G1B
SCHEMBL7459486 0.83 LCK (0.48) LCKFYNALDH1A1SERPINE1MAPT
SCHEMBL4603990 0.83 ALDH1A1 (0.44) ALDH1A1TSHRGPR35JMJD6PLA2G1B

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-100480327-C Aliphatic polyester resin composition, aliphatic polyester resin molded article, and method for producing aliphatic polyester resin molded article TAKEMOTO OIL & FAT CO LTD (JP) 2009-04-22 CN disclosed
CN-1910236-A Aliphatic polyester resin composition, aliphatic polyester resin molded article, and method for producing aliphatic polyester resin molded article TAKEMOTO OIL & FAT CO LTD (JP) 2007-02-07 CN disclosed