SCHEMBL24682970

SCHEMBL24682970

CC(=O)N(Cc1ccccc1F)c1sc2c(Cl)c(O)ccc2c1C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 6/20 0.36
▸ MEN1 O00255 4/20 0.36
▸ CLCN2 P51788 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ ATM Q13315 2/20 0.34
▸ CXCR3 P49682 1/20 0.34
▸ FEN1 P39748 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ ESR1 P03372 2/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ MAOB P27338 1/20 0.33
▸ HCAR3 P49019 1/20 0.32
▸ RIPK1 Q13546 1/20 0.32
▸ RECQL P46063 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
SCHEMBL30664665 0.91 HSP90AA1 (0.38) KMT2AMEN1CLCN2ALDH1A1KDM4E
SCHEMBL24683191 0.91 HSP90AA1 (0.38) KMT2AMEN1CLCN2ALDH1A1KDM4E
SCHEMBL30701705 0.90 MCL1 (0.39) KMT2AMEN1NPC1RAB9AL3MBTL1
SCHEMBL24683876 0.90 MCL1 (0.39) KMT2AMEN1NPC1RAB9AL3MBTL1
SCHEMBL24682820 0.89 KMT2A (0.35) KMT2AMEN1CLCN2ALDH1A1KDM4E
SCHEMBL29799909 0.88 BCKDK (0.35) KMT2AMEN1MAOBRIPK1
SCHEMBL24683895 0.88 BCKDK (0.35) KMT2AMEN1MAOBRIPK1
SCHEMBL29800055 0.86 TSPO (0.40) KMT2AMEN1ALDH1A1NPC1RAB9A
SCHEMBL24682198 0.86 TSPO (0.40) KMT2AMEN1ALDH1A1NPC1RAB9A
SCHEMBL24683224 0.82 HSP90AA1 (0.39) ALDH1A1KDM4EATMNPC1RAB9A

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
Send feedback