SCHEMBL31314568

SCHEMBL31314568

CCCCc1oc2ccccc2c1C(=O)N1CCOCC1

nearest known ligand 0.66

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SIRT3 Q9NTG7 16/20 0.66
▸ EYA3 Q99504 2/20 0.57
▸ PTPN1 P18031 1/20 0.57
▸ TTR P02766 1/20 0.56
▸ ALDH1A1 P00352 1/20 0.48

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
SCHEMBL31314684 0.90 SIRT3 (0.74) SIRT3EYA3PTPN1TTR
SCHEMBL31314611 0.89 SIRT3 (0.65) SIRT3EYA3PTPN1TTRALDH1A1
SCHEMBL4503394 0.81 SIRT3 (0.55) SIRT3EYA3PTPN1TTR
SCHEMBL31314610 0.80 SIRT3 (0.74) SIRT3EYA3PTPN1TTR
SCHEMBL27992957 0.79 EYA3 (0.80) SIRT3EYA3PTPN1TTR
SCHEMBL13600960 0.78 SIRT3 (0.52) SIRT3EYA3PTPN1TTR
SCHEMBL4503396 0.78 SIRT3 (0.52) SIRT3EYA3PTPN1TTR
SCHEMBL2944813 0.78 PTPN1 (0.69) SIRT3EYA3PTPN1TTR
SCHEMBL2943743 0.77 PTPN1 (0.67) SIRT3EYA3PTPN1TTR
Hydrochloric Acid SCHEMBL9347277 0.77 PTPN1 (0.67) SIRT3EYA3PTPN1TTRALDH1A1

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
WO-2024261504-A1 BENZOFURAN-3-CARBOXYLIC ACID AMIDES AND BENZOFURAN-3- CARBONYL-BENZAMIDES, METHOD FOR THEIR PRODUCTION WITH HIGH SELECTIVITY, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM PÉCSI TUDOMÁNYEGYETEM (HU) 2024-12-26 — — WO claimed
WO-2024261504-A1 BENZOFURAN-3-CARBOXYLIC ACID AMIDES AND BENZOFURAN-3- CARBONYL-BENZAMIDES, METHOD FOR THEIR PRODUCTION WITH HIGH SELECTIVITY, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM PÉCSI TUDOMÁNYEGYETEM (HU) 2024-12-26 — — WO disclosed
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