SCHEMBL24683206

SCHEMBL24683206

COC(=O)c1c(N(Cc2ccccc2Cl)C(C)=O)sc2c(CN(C)C)c(O)ccc12

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ MAPT P10636 4/20 0.38
▸ KDM4E B2RXH2 3/20 0.38
▸ HPGD P15428 2/20 0.38
▸ TDP1 Q9NUW8 2/20 0.35
▸ HSP90AA1 P07900 3/20 0.35
▸ HSP90B1 P14625 2/20 0.35
▸ PDE3B Q13370 1/20 0.34
▸ PDE3A Q14432 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ TSPO P30536 2/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ KMT2A Q03164 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
SCHEMBL24682963 0.90 KMT2A (0.34) LMNAMAPTKDM4EHPGDTDP1
SCHEMBL24683840 0.89 KDM4E (0.34) LMNAMAPTKDM4EHPGDTDP1
SCHEMBL24683205 0.89 LMNA (0.38) LMNASMN1; SMN2MAPTKDM4EHPGD
SCHEMBL29799927 0.89 LMNA (0.38) LMNASMN1; SMN2MAPTKDM4EHPGD
SCHEMBL24682191 0.87 NPSR1 (0.36) LMNAMAPTKDM4EHPGDTDP1
SCHEMBL24683871 0.86 POLB (0.37) MAPTKDM4EHPGDTDP1HSP90AA1
SCHEMBL24682809 0.86 ALDH1A1 (0.34) LMNAMAPTKDM4EHPGDTDP1
SCHEMBL24683891 0.84 TAAR1 (0.36) LMNAMAPTKDM4EHPGDTDP1
SCHEMBL29800145 0.84 TAAR1 (0.36) LMNAMAPTKDM4EHPGDTDP1
SCHEMBL24682827 0.82 RIPK1 (0.34) MAPTKDM4EHPGDHSP90AA1HSP90B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022173329-A1 2-ACETAMIDO-6-HYDROXY-BENZOTHIOPHENE DERIVATIVES WITH ANTIVIRAL ACTIVITY Акционерное общество "Отисифарм" 2022-08-18 — — WO disclosed
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