SCHEMBL21387596

SCHEMBL21387596

CCC(C=O)c1ccnc(NS(=O)(=O)C2CC2)n1

nearest known ligand 0.53

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ CTPS1 P17812 20/20 0.53

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
SCHEMBL21382338 0.84 CTPS1 (0.53) CTPS1
SCHEMBL22924884 0.80 CTPS1 (0.61) CTPS1
SCHEMBL21387657 0.79 CTPS1 (0.34) CTPS1
Potassium Ion SCHEMBL21373735 0.78 CTPS1 (0.59) CTPS1
SCHEMBL21373705 0.78 CTPS1 (0.59) CTPS1
SCHEMBL30415580 0.74 CTPS1 (0.69) CTPS1
SCHEMBL21392172 0.73 CTPS1 (0.49) CTPS1
SCHEMBL30416059 0.73 CTPS1 (0.49) CTPS1
SCHEMBL21373830 0.73 CTPS1 (0.57) CTPS1
SCHEMBL25778800 0.72 CTPS1 (0.49) 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
EP-3543232-A1 AMINOPYRIMIDINE DERIVATIVES AS CTPS1 INHIBITORS Step Pharma S.A.S. (FR) 2019-09-25 — — EP disclosed
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