SCHEMBL7203856

SCHEMBL7203856

C=C(C)C(=O)OCC1CO1.C=C(C)C(=O)OCCCC.C=C(CC=Cc1ccccc1)C(=O)OC

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 2/20 0.42
TDP1 Q9NUW8 2/20 0.40
MGLL Q99685 1/20 0.39
TSHR P16473 2/20 0.36
POLB P06746 3/20 0.35
APEX1 P27695 1/20 0.35
HTT P42858 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
USP2 O75604 1/20 0.34
MAPT P10636 1/20 0.34
MAPK1 P28482 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
SCHEMBL5025894 0.93 ALDH1A1 (0.41) ALDH1A1KDM4ETDP1MGLLTSHR
SCHEMBL17454498 0.92 ALDH1A1 (0.53) ALDH1A1MGLL
SCHEMBL15674600 0.92 ALDH1A1 (0.39) ALDH1A1KDM4ETDP1MGLLTSHR
SCHEMBL9168880 0.91 ALDH1A1 (0.37) ALDH1A1KDM4ETDP1MGLLTSHR
SCHEMBL19064565 0.90 ALDH1A1 (0.38) ALDH1A1KDM4ETDP1MGLLTSHR
SCHEMBL7892714 0.89 TDP1 (0.48) KDM4ETDP1TSHRPOLBAPEX1
SCHEMBL3627784 0.89 ALDH1A1 (0.50) ALDH1A1MGLL
SCHEMBL11223220 0.87 ALDH1A1 (0.40) ALDH1A1KDM4ETDP1MGLLTSHR
SCHEMBL10524492 0.86 ALDH1A1 (0.46) ALDH1A1KDM4ETDP1MGLLTSHR
SCHEMBL908016 0.85 MGLL (0.43) ALDH1A1KDM4ETDP1MGLLTSHR

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
JP-2003176453-A POWDER COATING MATERIAL EXCELLENT IN POWDERY FLOW KANSAI PAINT CO LTD 2003-06-24 JP disclosed