SCHEMBL30356232

SCHEMBL30356232

COc1ccc([N+](=O)[O-])c(C(=O)O)c1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 5/20 0.53
L3MBTL1 Q9Y468 3/20 0.53
KDM4E B2RXH2 1/20 0.47
POLB P06746 1/20 0.47
CTDSP1 Q9GZU7 1/20 0.47
MAPT P10636 6/20 0.46
ALDH1A1 P00352 4/20 0.46
TTR P02766 1/20 0.46
TSHR P16473 3/20 0.45
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
TPMT P51580 1/20 0.44
JUN P05412 1/20 0.44
CYP3A4 P08684 1/20 0.44
HTT P42858 1/20 0.44
KMT2A Q03164 3/20 0.43

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
SCHEMBL31146147 0.87 TDP1 (0.53) TDP1L3MBTL1KDM4EPOLBCTDSP1
SCHEMBL1448299 0.87 TDP1 (0.53) TDP1L3MBTL1KDM4EPOLBCTDSP1
SCHEMBL31146138 0.87 TDP1 (0.53) TDP1L3MBTL1KDM4EPOLBCTDSP1
SCHEMBL29471422 0.86 L3MBTL1 (0.46) TDP1L3MBTL1KDM4EPOLBCTDSP1
SCHEMBL1319057 0.84 MAPT (0.55) TDP1L3MBTL1KDM4EPOLBCTDSP1
SCHEMBL9064266 0.82 CA12 (0.63) TDP1L3MBTL1KDM4EPOLBMAPT
SCHEMBL8349793 0.81 ALDH1A1 (0.50) TDP1L3MBTL1KDM4EPOLBCTDSP1
SCHEMBL21177973 0.81 TDP1 (0.62) TDP1L3MBTL1POLBMAPTALDH1A1
SCHEMBL68284 0.81 TDP1 (0.53) TDP1L3MBTL1KDM4EPOLBCTDSP1
SCHEMBL3224897 0.81 KMT2A (0.55) TDP1L3MBTL1KDM4EPOLBCTDSP1

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
EP-3468363-B2 USE OF N-SUBSTITUTED PYRROLIDONES TO PROMOTE THE PENETRATION OF AGROCHEMICAL ACTIVE AGENTS CLARIANT INT LTD (CH) 2025-12-17 EP disclosed
CN-113329632-B Fatty acid derivatives for improving the efficacy of agrochemically active substances 科莱恩国际有限公司 2023-10-27 CN disclosed
EP-3556211-B1 ORGANIC AMMONIUM SALTS OF ANIONIC PESTICIDES CLARIANT INT LTD (CH) 2023-01-25 EP disclosed