SCHEMBL28489577

SCHEMBL28489577

CC(C)(C(=O)Nc1ccc(-c2ccccc2)c(C#N)c1)c1ccnc(NS(=O)(=O)C2CC2)n1

nearest known ligand 0.70

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ CTPS1 P17812 20/20 0.70

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
SCHEMBL28483148 0.87 CTPS1 (0.73) CTPS1
SCHEMBL21373833 0.83 CTPS1 (1.00) CTPS1
SCHEMBL21373712 0.79 CTPS1 (1.00) CTPS1
SCHEMBL21373769 0.79 CTPS1 (1.00) CTPS1
SCHEMBL21044307 0.78 CTPS1 (0.75) CTPS1
SCHEMBL21373720 0.78 CTPS1 (1.00) CTPS1
SCHEMBL30528920 0.77 CTPS1 (1.00) CTPS1
SCHEMBL21373746 0.77 CTPS1 (1.00) CTPS1
SCHEMBL21373778 0.76 CTPS1 (1.00) CTPS1
SCHEMBL21373857 0.75 CTPS1 (1.00) 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 2 patents. 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
CN-111868051-A Aminopyrimidine derivatives as CTPS1 inhibitors 斯泰普制药股份公司 2020-10-30 — — CN disclosed
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