SCHEMBL29479685

SCHEMBL29479685

CC(=O)Nc1cc2nc(-c3ccnc(C(=O)O)c3)oc2cc1F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.46
▸ THRB P10828 1/20 0.46
▸ RAB9A P51151 8/20 0.46
▸ NPC1 O15118 7/20 0.46
▸ POLB P06746 4/20 0.46
▸ KDM4E B2RXH2 4/20 0.46
▸ SMN1; SMN2 Q16637 4/20 0.46
▸ CASP3 P42574 3/20 0.46
▸ SENP7 Q9BQF6 3/20 0.46
▸ ALDH1A1 P00352 3/20 0.46
▸ SENP8 Q96LD8 2/20 0.46
▸ SENP6 Q9GZR1 2/20 0.46
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ HPSE Q9Y251 5/20 0.44
▸ UTRN P46939 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.42
▸ HPGD P15428 2/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ NFKB1 P19838 1/20 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
SCHEMBL28713359 1.00 LMNA (0.46) LMNATHRBRAB9ANPC1POLB
SCHEMBL28710833 0.89 MAPT (0.47) LMNATHRBRAB9ANPC1POLB
SCHEMBL29479645 0.89 MAPT (0.47) LMNATHRBRAB9ANPC1POLB
SCHEMBL23012658 0.87 LMNA (0.46) LMNATHRBRAB9ANPC1POLB
SCHEMBL23012175 0.81 NPC1 (0.70) LMNARAB9ANPC1POLBKDM4E
SCHEMBL23033959 0.81 CASP3 (0.70) LMNARAB9ANPC1POLBKDM4E
SCHEMBL29479597 0.81 NPC1 (0.70) LMNARAB9ANPC1POLBKDM4E
SCHEMBL23033969 0.77 ALDH1A1 (0.36) LMNATHRBRAB9ANPC1POLB
SCHEMBL28711116 0.74 SMN1; SMN2 (0.59) RAB9ANPC1POLBKDM4ESMN1; SMN2
SCHEMBL29479777 0.74 SMN1; SMN2 (0.59) RAB9ANPC1POLBKDM4ESMN1; 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 2 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
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