SCHEMBL28190026

SCHEMBL28190026

C=CC(=O)OC(=O)CCCCCCCCCCC(=O)OC.[CaH2]

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.59
LMNA P02545 2/20 0.59
TSHR P16473 6/20 0.50
EPHX2 P34913 4/20 0.40
CYP3A4 P08684 1/20 0.39
KMT2A Q03164 2/20 0.39
POLB P06746 1/20 0.39
POLA1 P09884 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.37
RECQL P46063 1/20 0.37
HPGD P15428 2/20 0.36
MEN1 O00255 1/20 0.34

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
SCHEMBL28190010 0.98 ALDH1A1 (0.61) ALDH1A1LMNATSHREPHX2CYP3A4
SCHEMBL28189938 0.98 LMNA (0.56) ALDH1A1LMNATSHREPHX2CYP3A4
SCHEMBL28189944 0.96 ALDH1A1 (0.59) ALDH1A1LMNATSHREPHX2CYP3A4
SCHEMBL28190035 0.96 ALDH1A1 (0.59) ALDH1A1LMNATSHREPHX2CYP3A4
SCHEMBL28036724 0.96 LMNA (0.58) ALDH1A1LMNATSHREPHX2CYP3A4
SCHEMBL28189977 0.94 LMNA (0.56) ALDH1A1LMNATSHREPHX2CYP3A4
SCHEMBL28190016 0.94 LMNA (0.56) ALDH1A1LMNATSHREPHX2CYP3A4
SCHEMBL28190588 0.94 LMNA (0.56) ALDH1A1LMNATSHREPHX2CYP3A4
SCHEMBL28082338 0.90 TSHR (0.54) ALDH1A1LMNATSHRCYP3A4KMT2A
SCHEMBL28167910 0.88 TSHR (0.56) ALDH1A1LMNATSHRCYP3A4KMT2A

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-105814092-B Composition for hydrophilic cured product 三井化学株式会社 2018-09-21 CN disclosed
CN-107430213-A Hydrophilic optical feature monofilm and its layered product 三井化学株式会社 2017-12-01 CN disclosed