SCHEMBL30597678

SCHEMBL30597678

CC(=O)O/N=C1/C(c2c(O)[nH]c3cc(Cl)ccc23)=Nc2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GSK3A P49840 15/20 1.00
▸ GSK3B P49841 15/20 1.00
▸ CDK5 Q00535 13/20 1.00
▸ CDK5R1 Q15078 13/20 1.00
▸ CCNB2 O95067 11/20 1.00
▸ CDK1 P06493 11/20 1.00
▸ CCNB1 P14635 11/20 1.00
▸ CCNB3 Q8WWL7 11/20 1.00
▸ AHR P35869 1/20 0.79
▸ AURKC Q9UQB9 6/20 0.78
▸ AURKB Q96GD4 5/20 0.78
▸ AURKA O14965 4/20 0.78
▸ FLT3 P36888 1/20 0.55

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
SCHEMBL29359170 0.88 CDK1 (1.00) GSK3AGSK3BCDK5CDK5R1CCNB2
SCHEMBL29447183 0.88 CDK1 (1.00) GSK3AGSK3BCDK5CDK5R1CCNB2
SCHEMBL30319811 0.88 GSK3B (1.00) GSK3AGSK3BCDK5CDK5R1CCNB2
SCHEMBL31060593 0.88 GSK3B (1.00) GSK3AGSK3BCDK5CDK5R1CCNB2
SCHEMBL30094663 0.79 GSK3A (1.00) GSK3AGSK3BCDK5CDK5R1CCNB2
SCHEMBL31060440 0.77 AURKC (1.00) GSK3AGSK3BCDK5CDK5R1CCNB2
SCHEMBL31061457 0.77 GSK3A (1.00) GSK3AGSK3BCDK5CDK5R1CCNB2
SCHEMBL29664066 0.76 GSK3A (0.78) GSK3AGSK3BCDK5CDK5R1CCNB2
SCHEMBL30319832 0.76 CDK1 (1.00) GSK3AGSK3BCDK5CDK5R1CCNB2
SCHEMBL30597656 0.74 GSK3B (1.00) GSK3AGSK3BCDK5CDK5R1CCNB2

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
EP-4466342-A1 METHOD FOR REPROGRAMMING CD8+ T CELLS TO ENHANCE THEIR THERAPEUTIC POTENTIAL AND APPLICATIONS THEREOF Institut Pasteur (FR) 2024-11-27 — — EP disclosed
WO-2023139242-A1 METHOD FOR REPROGRAMMING CD8+ T CELLS TO ENHANCE THEIR THERAPEUTIC POTENTIAL AND APPLICATIONS THEREOF INSTITUT PASTEUR (FR) 2023-07-27 — — WO disclosed
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