SCHEMBL6277447

SCHEMBL6277447

C=C(C)C(=O)OC.C=C(C)C(=O)OCC1CO1.C=CC(=O)OCCO.C=CC(=O)OCCOS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
TSHR P16473 1/20 0.33
PSMD10 O75832 1/20 0.32
STAT3 P40763 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
PKM P14618 1/20 0.30

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
SCHEMBL6282778 0.99 ALDH1A1 (0.42) ALDH1A1CA1CA2TSHRPSMD10
SCHEMBL6279939 0.99 ALDH1A1 (0.42) ALDH1A1CA1CA2TSHRPSMD10
SCHEMBL6275789 0.95 ALDH1A1 (0.42) ALDH1A1CA1CA2PSMD10
SCHEMBL6278456 0.94 ALDH1A1 (0.41) ALDH1A1CA1CA2PSMD10
SCHEMBL6280475 0.94 ALDH1A1 (0.41) ALDH1A1CA1CA2PSMD10
SCHEMBL6275438 0.94 ALDH1A1 (0.41) ALDH1A1CA1CA2PSMD10
Acrylic Acid Methyl Ester SCHEMBL6281829 0.94 ALDH1A1 (0.44) ALDH1A1CA1CA2PSMD10STAT3
SCHEMBL6277451 0.93 ALDH1A1 (0.40) ALDH1A1CA1CA2PSMD10
SCHEMBL6281857 0.91 ALDH1A1 (0.41) ALDH1A1CA1CA2PSMD10STAT3
SCHEMBL6281597 0.90 CA1 (0.39) ALDH1A1CA1CA2TSHRPSMD10

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