SCHEMBL21387667

SCHEMBL21387667

CC(C)(C(=O)Nc1ccc(-c2cccc(Cl)c2)cc1)c1ccnc(N[S+]([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
SCHEMBL21387620 0.89 CTPS1 (0.70) CTPS1
SCHEMBL21387641 0.87 CTPS1 (0.70) CTPS1
SCHEMBL21387625 0.86 CTPS1 (0.68) CTPS1
SCHEMBL21077135 0.83 CTPS1 (0.52) CTPS1
SCHEMBL21373712 0.82 CTPS1 (1.00) CTPS1
SCHEMBL21387735 0.77 CTPS1 (0.69) CTPS1
SCHEMBL21373686 0.72 CTPS1 (1.00) CTPS1
SCHEMBL21077065 0.72 CTPS1 (0.53) CTPS1
SCHEMBL21373746 0.72 CTPS1 (1.00) CTPS1
SCHEMBL30528920 0.72 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 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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