SCHEMBL23174787

SCHEMBL23174787

Oc1ccc(Cc2cccc(C3CCCCC3)c2O)c(O)c1O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NUDT1 P36639 1/20 0.39
▸ BACE1 P56817 1/20 0.39
▸ CETP P11597 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.36
▸ PTPN5 P54829 3/20 0.36
▸ PTPN2 P17706 1/20 0.36
▸ NAAA Q02083 1/20 0.36
▸ PTGDR2 Q9Y5Y4 1/20 0.35
▸ DRD1 P21728 3/20 0.34
▸ ADRA2A P08913 1/20 0.34
▸ ADRA2B P18089 1/20 0.34
▸ ADRA2C P18825 1/20 0.34
▸ ADRA1D P25100 1/20 0.34
▸ ADRA1A P35348 1/20 0.34
▸ ADRA1B P35368 1/20 0.34
▸ FEN1 P39748 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
SCHEMBL4058553 0.91 PTGDR2 (0.41) NUDT1BACE1HSP90AA1PTPN5PTPN2
SCHEMBL11598412 0.89 PTPN5 (0.39) NUDT1BACE1HSP90AA1PTPN5PTPN2
SCHEMBL29493115 0.86 HSPA5 (0.50) NUDT1BACE1PTPN5PTPN2NAAA
SCHEMBL27584479 0.86 HSPA5 (0.50) NUDT1BACE1PTPN5PTPN2NAAA
SCHEMBL27221198 0.82 AMY1A (0.51) NUDT1BACE1CETPHSP90AA1PTPN5
SCHEMBL10607806 0.80 NUDT1 (0.46) NUDT1BACE1HSP90AA1PTPN5DRD1
SCHEMBL23174721 0.79 NUDT1 (0.38) NUDT1BACE1CETPHSP90AA1PTPN5
SCHEMBL27728789 0.79 PTGDR2 (0.40) NUDT1BACE1HSP90AA1PTPN5PTPN2
SCHEMBL27584478 0.79 KEAP1 (0.45) NUDT1BACE1PTPN5PTPN2NAAA
SCHEMBL1053897 0.78 HDAC4 (0.46) NUDT1BACE1HSP90AA1PTPN5PTPN2

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
US-20240166812-A1 POLYPHENYLENE ETHER, PRODUCTION METHOD OF THE SAME, THERMOSETTING COMPOSITION, PREPREG, AND LAMINATE ASAHI KASEI KABUSHIKI KAISHA (JP) 2024-05-23 — — US disclosed
WO-2021065275-A1 POLYPHENYLENE ETHER COMPOSITION 旭化成株式会社 2021-04-08 — — WO disclosed
CN-101033293-B Polyfunctional phenylene ether oligomer, derivative thereof, resin composition containing the same, and use thereof MITSUBISHI GAS CHEMICAL CO 2011-11-16 — — CN disclosed
CN-101033293-A Polyfunctional phenylene ether oligomer, derivative thereof, resin composition containing the same, and use thereof MITSUBISHI GAS CHEMICAL CO (JP) 2007-09-12 — — CN disclosed
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