SCHEMBL29228050

SCHEMBL29228050

COCCC(C(=O)O)c1ccnc(NS(=O)(=O)C2CC2)n1.[KH]

nearest known ligand 0.49

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ CTPS1 P17812 20/20 0.49

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
SCHEMBL22924763 0.99 CTPS1 (0.50) CTPS1
Potassium SCHEMBL30882879 0.98 CTPS1 (0.49) CTPS1
SCHEMBL21373755 0.91 CTPS1 (0.50) CTPS1
Potassium Ion SCHEMBL21373800 0.89 CTPS1 (0.49) CTPS1
SCHEMBL22924884 0.85 CTPS1 (0.61) CTPS1
SCHEMBL25293858 0.81 CTPS1 (0.51) CTPS1
SCHEMBL21373705 0.81 CTPS1 (0.59) CTPS1
SCHEMBL25778800 0.80 CTPS1 (0.49) CTPS1
SCHEMBL21392146 0.80 CTPS1 (0.32) CTPS1
SCHEMBL21381572 0.79 CTPS1 (0.48) CTPS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111868051-B Aminopyrimidine derivatives as CTPS1 inhibitors 斯泰普制药股份公司 2024-04-09 — — CN disclosed
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