SCHEMBL6521039

SCHEMBL6521039

CCC(=O)COC(=O)/C=C/C(=O)OC

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 7/20 0.54
KEAP1 Q14145 1/20 0.54
NFE2L2 Q16236 1/20 0.54
ATM Q13315 1/20 0.42
MAPT P10636 7/20 0.39
LMNA P02545 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MDM4 O15151 1/20 0.36
MDM2 Q00987 1/20 0.36
TDP1 Q9NUW8 2/20 0.36
RAB9A P51151 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
GFPT1 Q06210 1/20 0.36
ALDH1A1 P00352 4/20 0.35
THRB P10828 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL6522618 0.91 HCAR2 (0.48) HCAR2KEAP1NFE2L2ATMMAPT
SCHEMBL17048353 0.89 HCAR2 (0.62) HCAR2KEAP1NFE2L2ATMMAPT
SCHEMBL17048352 0.89 HCAR2 (0.62) HCAR2KEAP1NFE2L2ATMMAPT
SCHEMBL6522639 0.85 HCAR2 (0.59) HCAR2ATMMAPTLMNAL3MBTL1
SCHEMBL6516717 0.82 ATM (0.47) HCAR2KEAP1NFE2L2ATMMAPT
SCHEMBL1755556 0.81 HCAR2 (0.39) HCAR2ATMMAPTLMNATDP1
SCHEMBL18352094 0.79 HCAR2 (0.41) HCAR2KEAP1NFE2L2ATMMAPT
SCHEMBL2627702 0.78 HCAR2 (0.59) HCAR2KEAP1NFE2L2ATMMAPT
SCHEMBL2114266 0.78 HCAR2 (0.59) HCAR2KEAP1NFE2L2ATMMAPT
SCHEMBL6522650 0.78 HCAR2 (0.59) HCAR2KEAP1NFE2L2ATMMAPT

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-6958366-B2 Antifouling coating composition and novel resin DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-10-25 US disclosed