SCHEMBL23033587

SCHEMBL23033587

Cn1cncc1-c1ccc2oc(-c3ccnc(C(=O)O)c3)cc2c1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 19/20 0.43
▸ DYRK1A Q13627 19/20 0.43
▸ WNT1 P04628 6/20 0.43
▸ MMP2 P08253 1/20 0.40
▸ MMP13 P45452 1/20 0.40
▸ MMP14 P50281 1/20 0.40

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
SCHEMBL23012523 0.89 GSK3B (0.45) GSK3BDYRK1AWNT1MMP2MMP13
SCHEMBL29479664 0.89 GSK3B (0.45) GSK3BDYRK1AWNT1MMP2MMP13
SCHEMBL23033305 0.82 HDAC6 (0.40) GSK3BDYRK1AWNT1
SCHEMBL28707158 0.80 GSK3B (0.40) GSK3BDYRK1AWNT1
SCHEMBL29479668 0.80 GSK3B (0.40) GSK3BDYRK1AWNT1
SCHEMBL23012691 0.80 PIM1 (0.65) GSK3BDYRK1AWNT1
SCHEMBL23033375 0.70 NPC1 (0.47) —
SCHEMBL29479803 0.69 MMP2 (0.51) GSK3BDYRK1AWNT1MMP2MMP13
SCHEMBL23012957 0.69 MMP2 (0.51) GSK3BDYRK1AWNT1MMP2MMP13
SCHEMBL23033316 0.67 ALDH1A1 (0.41) —

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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