SCHEMBL24682200

SCHEMBL24682200

CNC(=O)c1c(N(Cc2ccccc2F)C(C)=O)sc2cc(O)ccc12

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 4/20 0.44
▸ HPGD P15428 3/20 0.36
▸ MAPT P10636 2/20 0.35
▸ GAA P10253 2/20 0.35
▸ TP53 P04637 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ CHRM4 P08173 1/20 0.34
▸ ESR1 P03372 1/20 0.33
▸ ESR2 Q92731 1/20 0.33
▸ HSD17B13 Q7Z5P4 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ RXFP1 Q9HBX9 1/20 0.33

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
SCHEMBL29800150 1.00 MAOB (0.44) MAOBHPGDMAPTGAATP53
SCHEMBL24683894 0.89 MAOB (0.39) MAOBHPGDMAPTALDH1A1MAPK1
SCHEMBL29800052 0.89 MAOB (0.39) MAOBHPGDMAPTALDH1A1MAPK1
SCHEMBL30701683 0.88 MAOB (0.39) MAOBHPGDMAPTGAAALDH1A1
SCHEMBL24682969 0.88 MAOB (0.39) MAOBHPGDMAPTGAAALDH1A1
SCHEMBL24682202 0.85 PDK1 (0.45) MAOBMAPTMEN1KMT2AESR1
SCHEMBL29799815 0.85 PDK1 (0.45) MAOBMAPTMEN1KMT2AESR1
SCHEMBL24682820 0.80 KMT2A (0.35) HPGDGAARAB9AALDH1A1MEN1
SCHEMBL24683870 0.79 KMT2A (0.34) MAPTGAARAB9AALDH1A1TSHR
SCHEMBL30701647 0.79 KMT2A (0.34) MAPTGAARAB9AALDH1A1TSHR

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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