SCHEMBL23033561

SCHEMBL23033561

Cn1cc(-c2ccc3oc(-c4ccnc(C(=O)O)c4)nc3c2)cn1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 1/20 0.55
▸ PIM2 Q9P1W9 1/20 0.55
▸ MET P08581 3/20 0.44
▸ DYRK1A Q13627 6/20 0.42
▸ WNT1 P04628 4/20 0.42
▸ GSK3B P49841 2/20 0.42
▸ CCNC P24863 2/20 0.42
▸ CDK8 P49336 2/20 0.42
▸ ALK Q9UM73 1/20 0.41
▸ HPSE Q9Y251 4/20 0.40
▸ AURKB Q96GD4 1/20 0.40
▸ CLK2 P49760 1/20 0.39
▸ CLK3 P49761 1/20 0.39
▸ ABL1 P00519 1/20 0.39
▸ CHEK1 O14757 1/20 0.39

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
SCHEMBL28714669 0.88 PIM1 (0.40) PIM1PIM2HPSE
SCHEMBL29479615 0.87 MAOA (0.43) PIM1PIM2HPSE
SCHEMBL28706416 0.87 MAOA (0.43) PIM1PIM2HPSE
SCHEMBL29479701 0.87 KDM4E (0.44) PIM1PIM2DYRK1AWNT1GSK3B
SCHEMBL28714630 0.87 KDM4E (0.44) PIM1PIM2DYRK1AWNT1GSK3B
SCHEMBL28714674 0.86 PIM1 (0.44) PIM1PIM2METDYRK1AWNT1
SCHEMBL29479641 0.86 PIM1 (0.44) PIM1PIM2METDYRK1AWNT1
SCHEMBL28713867 0.86 GRK5 (0.51) PIM1PIM2MET
SCHEMBL29479792 0.86 GRK5 (0.51) PIM1PIM2MET
SCHEMBL29479735 0.85 S1PR1 (0.41) PIM1PIM2METHPSE

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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