SCHEMBL24683224

SCHEMBL24683224

COC(=O)c1c(N(CCc2ccccc2F)C(C)=O)sc2c(Cl)c(O)ccc12

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HSP90AA1 P07900 9/20 0.39
▸ HSP90B1 P14625 2/20 0.39
▸ LMNA P02545 2/20 0.35
▸ HTT P42858 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ PKM P14618 1/20 0.33
▸ TAAR1 Q96RJ0 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32

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
SCHEMBL30664668 1.00 HSP90AA1 (0.39) HSP90AA1HSP90B1LMNAHTTSMN1; SMN2
SCHEMBL24683191 0.91 HSP90AA1 (0.38) HSP90AA1HSP90B1LMNAHTTSMN1; SMN2
SCHEMBL30664665 0.91 HSP90AA1 (0.38) HSP90AA1HSP90B1LMNAHTTSMN1; SMN2
SCHEMBL29800145 0.87 TAAR1 (0.36) HSP90AA1HSP90B1LMNAHTTTDP1
SCHEMBL24683891 0.87 TAAR1 (0.36) HSP90AA1HSP90B1LMNAHTTTDP1
SCHEMBL24683888 0.87 HSP90AA1 (0.40) HSP90AA1HSP90B1LMNAPKMALDH1A1
SCHEMBL30701679 0.87 HSP90AA1 (0.40) HSP90AA1HSP90B1LMNAPKMALDH1A1
SCHEMBL29800061 0.85 TAAR1 (0.36) SMN1; SMN2TAAR1ALDH1A1NPC1RAB9A
SCHEMBL24683205 0.83 LMNA (0.38) HSP90AA1HSP90B1LMNASMN1; SMN2TDP1
SCHEMBL29799927 0.83 LMNA (0.38) HSP90AA1HSP90B1LMNASMN1; SMN2TDP1

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-117222630-A 2-acetamido-6-hydroxy-benzothiophene derivatives having antiviral activity OTC制药公司(JSC) 2023-12-12 — — CN disclosed
WO-2022173329-A1 2-ACETAMIDO-6-HYDROXY-BENZOTHIOPHENE DERIVATIVES WITH ANTIVIRAL ACTIVITY Акционерное общество "Отисифарм" 2022-08-18 — — WO disclosed
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