SCHEMBL23012156

SCHEMBL23012156

CCOC(=O)c1cc(-c2nc3cc(/C(N)=C/NO)ccc3o2)ccn1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.44
▸ HDAC6 Q9UBN7 13/20 0.43
▸ TP53 P04637 2/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ HDAC3 O15379 4/20 0.42
▸ HDAC1 Q13547 3/20 0.42
▸ HDAC2 Q92769 3/20 0.42
▸ HDAC8 Q9BY41 3/20 0.42
▸ RXFP1 Q9HBX9 2/20 0.41

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
SCHEMBL29479718 1.00 MAPT (0.44) MAPTHDAC6TP53RAB9ASMN1; SMN2
SCHEMBL23012158 1.00 MAPT (0.44) MAPTHDAC6TP53RAB9ASMN1; SMN2
SCHEMBL29479632 0.84 MAPT (0.48) MAPTHDAC6TP53RAB9ASMN1; SMN2
SCHEMBL28936297 0.84 MAPT (0.48) MAPTHDAC6TP53RAB9ASMN1; SMN2
SCHEMBL28695257 0.84 MAPT (0.50) MAPTHDAC6TP53HDAC3HDAC1
SCHEMBL29479729 0.84 MAPT (0.50) MAPTHDAC6TP53HDAC3HDAC1
SCHEMBL23033302 0.79 CETP (0.48) MAPTHDAC6TP53RAB9ASMN1; SMN2
SCHEMBL28706421 0.77 CETP (0.56) HDAC6
SCHEMBL29479831 0.77 CETP (0.56) HDAC6
SCHEMBL23033343 0.75 RAB9A (0.50) MAPTTP53RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114269725-B Anti-influenza virus compound, preparation method and application thereof 西藏海思科制药有限公司 2024-09-17 — — CN disclosed
CN-114269725-A Anti-influenza virus compound and preparation method and application thereof 四川海思科制药有限公司 2022-04-01 — — CN disclosed
WO-2021032209-A1 ANTI-INFLUENZA VIRUS COMPOUND, PREPARATION METHOD AND USE THEREOF 四川海思科制药有限公司 2021-02-25 — — WO disclosed
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