SCHEMBL29027295

SCHEMBL29027295

CC(C)C(=O)Oc1c(Br)c(Br)c(Br)c(Br)c1Br

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 2/20 0.41
▸ CA2 P00918 1/20 0.37
▸ PTPN1 P18031 1/20 0.37
▸ ALOX15 P16050 1/20 0.34
▸ MIF P14174 1/20 0.32
▸ ADRB2 P07550 1/20 0.31
▸ ADRA2A P08913 1/20 0.31
▸ DRD2 P14416 1/20 0.31
▸ ADRA2C P18825 1/20 0.31
▸ DRD1 P21728 1/20 0.31
▸ ADRA1A P35348 1/20 0.31
▸ DRD3 P35462 1/20 0.31
▸ KLKB1 P03952 1/20 0.31
▸ GAA P10253 1/20 0.31

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
SCHEMBL11915792 0.73 ELANE (0.42) ELANECA2ALOX15ADRB2ADRA2A
SCHEMBL9168595 0.72 CA2 (0.55) CA2PTPN1GAA
SCHEMBL11434932 0.71 OR51E2 (0.36) CA2
SCHEMBL21753716 0.71 PTPN1 (0.39) CA2PTPN1ALOX15
SCHEMBL9067587 0.71 PTPN1 (0.39) CA2PTPN1ALOX15
SCHEMBL24224798 0.70 PTPN1 (0.32) CA2PTPN1
SCHEMBL15557919 0.69 ALOX15 (0.41) ELANEALOX15ADRB2ADRA2ADRD2
SCHEMBL30786779 0.69 ALDH1A1 (0.50) ELANECA2ALOX15ADRB2ADRA2A
SCHEMBL16848728 0.68 TAS1R3 (0.40) ELANEALOX15GAA
SCHEMBL20398569 0.68 ELANE (0.50) ELANEALOX15KLKB1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116197983-B Antibacterial mildew-proof wood and preparation method thereof 江苏零界科技集团有限公司 2024-02-06 — — CN disclosed
CN-116197983-A Antibacterial mildew-proof wood and preparation method thereof 江苏零界科技集团有限公司 2023-06-02 — — CN disclosed
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