SCHEMBL6281597

SCHEMBL6281597

C=C(C)C(=O)OC.C=C(C)C(=O)OCCOS(=O)(=O)c1ccc(C)cc1.C=CC(=O)OCCO

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.39
TSHR P16473 3/20 0.39
CA2 P00918 2/20 0.39
PSMD10 O75832 1/20 0.36
STAT3 P40763 2/20 0.34
THRB P10828 2/20 0.33
NPSR1 Q6W5P4 1/20 0.32
CA12 O43570 1/20 0.32
CA9 Q16790 1/20 0.32
CTDSP1 Q9GZU7 1/20 0.31
SIRT5 Q9NXA8 1/20 0.31
CYP3A4 P08684 2/20 0.31
CYP2C9 P11712 2/20 0.31
CYP2C19 P33261 2/20 0.31
PKM P14618 1/20 0.31
ALDH1A1 P00352 5/20 0.31
TP53 P04637 2/20 0.31
HIF1A Q16665 2/20 0.31
CYP1A2 P05177 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL6278440 1.00 CA1 (0.39) CA1TSHRCA2PSMD10STAT3
SCHEMBL6275727 0.98 TSHR (0.40) CA1TSHRCA2PSMD10STAT3
SCHEMBL6275859 0.94 CA1 (0.38) CA1TSHRCA2PSMD10STAT3
SCHEMBL6278376 0.94 CA1 (0.38) CA1TSHRCA2PSMD10STAT3
SCHEMBL6280694 0.93 CA1 (0.40) CA1TSHRCA2PSMD10STAT3
SCHEMBL6272048 0.93 CA1 (0.41) CA1CA2PSMD10STAT3THRB
SCHEMBL6283172 0.92 PSMD10 (0.38) CA1TSHRCA2PSMD10STAT3
SCHEMBL6279939 0.91 ALDH1A1 (0.42) CA1TSHRCA2PSMD10ALDH1A1
SCHEMBL6282778 0.91 ALDH1A1 (0.42) CA1TSHRCA2PSMD10ALDH1A1
SCHEMBL6281741 0.91 PSMD10 (0.37) CA1TSHRCA2PSMD10STAT3

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
US-6956091-B2 Organic anti-reflective polymer and preparation thereof HYUNDAI ELECTRONICS INDUSTRIES CO., LTD. (KR) 2005-10-18 US claimed