SCHEMBL21818715

SCHEMBL21818715

CCCCCCCC/C=C\CCCCCCCC(=O)NC1=CC(=O)C(=O)C=C1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SOAT2 O75908 1/20 0.56
▸ SOAT1 P35610 1/20 0.56
▸ PSMB11 A5LHX3 2/20 0.55
▸ PSMA7 O14818 2/20 0.55
▸ PSMB1 P20618 2/20 0.55
▸ PSMA1 P25786 2/20 0.55
▸ PSMA2 P25787 2/20 0.55
▸ PSMA3 P25788 2/20 0.55
▸ PSMA4 P25789 2/20 0.55
▸ PSMB8 P28062 2/20 0.55
▸ PSMB9 P28065 2/20 0.55
▸ PSMA5 P28066 2/20 0.55
▸ PSMB4 P28070 2/20 0.55
▸ PSMB6 P28072 2/20 0.55
▸ PSMB5 P28074 2/20 0.55
▸ PSMB10 P40306 2/20 0.55
▸ PSMB3 P49720 2/20 0.55
▸ PSMB2 P49721 2/20 0.55
▸ PSMA6 P60900 2/20 0.55
▸ PSMA8 Q8TAA3 2/20 0.55

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
SCHEMBL21819126 0.82 SOAT2 (0.56) SOAT2SOAT1PSMB11PSMA7PSMB1
SCHEMBL21818713 0.78 MGLL (0.44) TRPV1FAAH
Oleic Acid Anilide SCHEMBL4143902 0.72 SOAT2 (1.00) SOAT2SOAT1PSMB11PSMA7PSMB1
SCHEMBL29379899 0.72 SOAT2 (1.00) SOAT2SOAT1PSMB11PSMA7PSMB1
Oleic Acid Anilide SCHEMBL4143904 0.72 SOAT2 (1.00) SOAT2SOAT1PSMB11PSMA7PSMB1
SCHEMBL10602169 0.72 SOAT2 (0.69) SOAT2SOAT1PSMB11PSMA7PSMB1
SCHEMBL8765553 0.72 ACHE (0.50) SOAT2SOAT1PSMB11PSMA7PSMB1
SCHEMBL7746557 0.72 ACHE (0.50) SOAT2SOAT1PSMB11PSMA7PSMB1
SCHEMBL540383 0.71 TERT (0.66) SOAT1MEN1KMT2AMAPTFAAH
SCHEMBL2703278 0.71 TERT (0.66) SOAT1MEN1KMT2AMAPTFAAH

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
US-11312793-B2 Amino-quinone antipolymerants and methods of using ECOLAB USA INC. (US) 2022-04-26 — — US disclosed
CN-112739725-A Amino quinone anti-polymerization agents and methods of use thereof 埃科莱布美国股份有限公司 2021-04-30 — — CN disclosed
US-20200102408-A1 AMINO-QUINONE ANTIPOLYMERANTS AND METHODS OF USING ECOLAB USA INC. 2020-04-02 — — US disclosed
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