SCHEMBL26977202

SCHEMBL26977202

CCCC(C(=O)O)C1CC(C)(C)N(O)C(C)(C)C1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 1/20 0.35
AKR1A1 P14550 1/20 0.35
CHRM3 P20309 1/20 0.35
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
ADRA1A P35348 1/20 0.35
HRH1 P35367 1/20 0.35
DRD3 P35462 1/20 0.35
SLC6A3 Q01959 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
ALDH1A1 P00352 1/20 0.33
ALOX15 P16050 1/20 0.33
CPN1 P15169 2/20 0.33
CPB2 Q96IY4 2/20 0.33
GAA P10253 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL7879384 0.90 CA2 (0.37) ALDH1A1ALOX15CPN1CPB2GAA
SCHEMBL26977293 0.89 GPR84 (0.39)
SCHEMBL7509572 0.88 GPR84 (0.41)
SCHEMBL26977316 0.88 GPR84 (0.41)
SCHEMBL26977526 0.88 GPR84 (0.41)
SCHEMBL26977259 0.88 GPR84 (0.41)
SCHEMBL26977190 0.88 GPR84 (0.41)
SCHEMBL755538 0.88 GPR84 (0.41)
SCHEMBL26977574 0.88 GPR84 (0.41)
SCHEMBL7636900 0.88 GPR84 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4504690-B1 ANTIFOULANT COMPOSITIONS FOR VAPOR-SPACE APPLICATIONS ECOLAB USA INC (US) 2026-03-18 EP claimed
EP-3820846-B1 COMPOSITION FOR INHIBITING MONOMER POLYMERIZATION COMPRISING A NITROXIDE INHIBITOR, A QUINONE METHIDE RETARDER AND AN AMINE STABILIZER ECOLAB USA INC (US) 2024-01-03 EP claimed
CN-112533902-A Compositions comprising nitroxide inhibitors, quinone methide blockers and amine stabilizers to inhibit polymerization of monomers 埃科莱布美国股份有限公司 2021-03-19 CN claimed
CN-112533902-A Compositions comprising nitroxide inhibitors, quinone methide blockers and amine stabilizers to inhibit polymerization of monomers 埃科莱布美国股份有限公司 2021-03-19 CN disclosed