SCHEMBL9326902

SCHEMBL9326902

CC(C)(C)c1ccc(OC(=O)c2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)c(C(C)(C)C)c1.O=C(c1ccccc1)c1c(O)cccc1O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.45
MAPT P10636 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PTGS2 P35354 4/20 0.40
ALOX5 P09917 3/20 0.40
SERPINE1 P05121 1/20 0.39
NPSR1 Q6W5P4 2/20 0.39
MEN1 O00255 2/20 0.39
ESR1 P03372 2/20 0.39
KMT2A Q03164 2/20 0.39
ESR2 Q92731 2/20 0.39
JAK2 O60674 1/20 0.39
USP2 O75604 1/20 0.39
GAA P10253 1/20 0.39
ALOX15 P16050 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TNFRSF1A P19438 1/20 0.39
PTGS1 P23219 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
SCHEMBL9807328 0.86 SERPINE1 (0.48) MAPTTDP1L3MBTL1PTGS2ALOX5
SCHEMBL29350333 0.86 APEX1 (0.50) APEX1MAPTTDP1L3MBTL1PTGS2
SCHEMBL76989 0.86 APEX1 (0.50) APEX1MAPTTDP1L3MBTL1PTGS2
SCHEMBL8844966 0.82 TDP1 (0.60) APEX1MAPTTDP1L3MBTL1PTGS2
SCHEMBL29084444 0.81 HPGD (0.47) APEX1MAPTTDP1L3MBTL1PTGS2
SCHEMBL11655989 0.81 APEX1 (0.46) APEX1MAPTTDP1L3MBTL1PTGS2
SCHEMBL27577575 0.79 APEX1 (0.48) APEX1MAPTTDP1L3MBTL1NPSR1
SCHEMBL9807325 0.78 TNFRSF1A (0.49) TDP1L3MBTL1PTGS2ALOX5TNFRSF1A
SCHEMBL9635616 0.77 APEX1 (0.45) APEX1MAPTTDP1L3MBTL1PTGS2
Benzamide SCHEMBL21771957 0.77 TDP1 (0.54) APEX1MAPTTDP1L3MBTL1NPSR1

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-5359069-A Non-migrating 1-hydrocarbyloxy hindered amine derivatives as polymer stabilizers CIBA-GEIGY CORPORATION (US) 1994-10-25 US disclosed