SCHEMBL11575404

SCHEMBL11575404

COC(=O)c1ccc(S(=O)(=O)c2ccc(C(=O)OC)c(C(=O)O)c2)cc1C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.55
APEX1 P27695 2/20 0.55
CTDSP1 Q9GZU7 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
GAA P10253 2/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
TSHR P16473 2/20 0.44
ALDH1A1 P00352 2/20 0.44
KDM4E B2RXH2 3/20 0.44
LMNA P02545 2/20 0.44
CA2 P00918 3/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA7 P43166 1/20 0.43
PDK2 Q15119 1/20 0.43
PDK4 Q16654 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
HSD17B10 Q99714 2/20 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
SCHEMBL11574049 0.97 POLB (0.56) POLBAPEX1CTDSP1L3MBTL1GAA
SCHEMBL11576165 0.93 POLB (0.55) POLBAPEX1CTDSP1L3MBTL1GAA
SCHEMBL29290485 0.88 ALDH1A1 (0.56) POLBAPEX1CTDSP1L3MBTL1GAA
SCHEMBL28582979 0.87 ALDH1A1 (0.54) POLBAPEX1CTDSP1L3MBTL1GAA
SCHEMBL6578365 0.86 L3MBTL1 (0.47) POLBAPEX1CTDSP1L3MBTL1GAA
SCHEMBL21184259 0.85 ALDH1A1 (0.47) POLBAPEX1CTDSP1L3MBTL1GAA
SCHEMBL29364883 0.83 APEX1 (0.67) POLBAPEX1CTDSP1L3MBTL1GAA
SCHEMBL65212 0.83 APEX1 (0.67) POLBAPEX1CTDSP1L3MBTL1GAA
SCHEMBL1397921 0.83 APEX1 (0.67) POLBAPEX1CTDSP1L3MBTL1GAA
SCHEMBL29394064 0.83 APEX1 (0.67) POLBAPEX1CTDSP1L3MBTL1GAA

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-4097456-A Preparation of acetylene-substituted polyimide oligomers and polyimide polymers GULF RESEARCH & DEVELOPMENT COMPANY (US) 1978-06-27 US disclosed