SCHEMBL6283149

SCHEMBL6283149

C=C(OS(=O)(=O)c1ccc(C)cc1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
GAA P10253 3/20 0.43
STAT3 P40763 1/20 0.42
F2 P00734 2/20 0.42
PRSS1 P07477 2/20 0.42
PRSS2 P07478 2/20 0.42
PRSS3 P35030 2/20 0.42
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
MMP1 P03956 1/20 0.41
MMP2 P08253 1/20 0.41
MMP9 P14780 1/20 0.41
MMP8 P22894 1/20 0.41
MMP13 P45452 1/20 0.41
CA12 O43570 1/20 0.41
CA3 P07451 1/20 0.41
CA6 P23280 1/20 0.41
CA5A P35218 1/20 0.41

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
SCHEMBL7319789 0.83 ALDH1A1 (0.50) ALDH1A1MEN1KMT2AGAASTAT3
SCHEMBL8943095 0.82 ALDH1A1 (0.46) ALDH1A1KMT2AGAAF2PRSS1
SCHEMBL28003017 0.81 ALDH1A1 (0.52) ALDH1A1MEN1KMT2AGAAF2
SCHEMBL10637725 0.80 ALDH1A1 (0.60) ALDH1A1MEN1KMT2AGAAF2
SCHEMBL493845 0.80 ALDH1A1 (0.47) ALDH1A1MEN1KMT2AGAASTAT3
Acetic Acid SCHEMBL10733614 0.79 ALDH1A1 (0.50) ALDH1A1MEN1KMT2AGAASTAT3
SCHEMBL4119814 0.79 ALDH1A1 (0.46) ALDH1A1MEN1KMT2AGAAF2
SCHEMBL28867389 0.79 ALDH1A1 (0.46) ALDH1A1MEN1KMT2AGAAF2
SCHEMBL938973 0.79 ALDH1A1 (0.46) ALDH1A1MEN1KMT2AGAAF2
Ammonia Solution, Strong SCHEMBL9252460 0.79 ALDH1A1 (0.46) ALDH1A1MEN1KMT2AGAASTAT3

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111228124-B Rapidly curing and low shrinkage stress photopolymerizable dental composites 义获嘉伟瓦登特公司 2024-04-09 CN claimed
CN-111228124-B Rapidly curing and low shrinkage stress photopolymerizable dental composites 义获嘉伟瓦登特公司 2024-04-09 CN disclosed
US-6956091-B2 Organic anti-reflective polymer and preparation thereof HYUNDAI ELECTRONICS INDUSTRIES CO., LTD. (KR) 2005-10-18 US disclosed