SCHEMBL28048305

SCHEMBL28048305

CCCCCCC(C)c1ccccc1C=CC(=O)O

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 3/20 0.46
CYSLTR1 Q9Y271 3/20 0.46
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
NFKB1 P19838 1/20 0.43
CA4 P22748 1/20 0.43
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 2/20 0.40
PDE5A O76074 1/20 0.40
EGFR P00533 1/20 0.40
PLA2G2D Q9UNK4 1/20 0.39
GAA P10253 1/20 0.39
PTGER4 P35408 2/20 0.39
PTGER3 P43115 2/20 0.39
PTGER2 P43116 2/20 0.39
HTT P42858 1/20 0.38
MAPT P10636 1/20 0.38
PTGER1 P34995 1/20 0.38

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
SCHEMBL6851902 0.89 CA1 (0.47) CYSLTR2CYSLTR1CA1CA2NFKB1
SCHEMBL1958100 0.84 CYSLTR2 (0.43) CYSLTR2CYSLTR1CA1CA2NFKB1
SCHEMBL83533 0.83 SLC37A4 (0.47) CYSLTR2CYSLTR1CA1CA2NFKB1
Arundic Acid SCHEMBL5010028 0.83 CYSLTR2 (0.41) CYSLTR2CYSLTR1CA1CA2NFKB1
SCHEMBL6683043 0.80 ADH1B (0.39) CYSLTR2CYSLTR1ALDH1A1
SCHEMBL8523379 0.79 THRB (0.43) CYSLTR2CYSLTR1CA1CA2NFKB1
SCHEMBL8523376 0.79 THRB (0.43) CYSLTR2CYSLTR1CA1CA2NFKB1
SCHEMBL6686645 0.78 MEN1 (0.39) CYSLTR2CYSLTR1ALDH1A1HTT
SCHEMBL1082121 0.77 HTT (0.50) CA1CA2NFKB1CA4ALDH1A1
SCHEMBL29183951 0.77 CSNK1E (0.41) CYSLTR2CYSLTR1ALDH1A1

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
CN-105232373-A Radiation protective moisturizer and preparation method thereof SUZHOU COSMETIC MATERIALS CO LTD 2016-01-13 CN disclosed