SCHEMBL21387638

SCHEMBL21387638

CCOc1cncc(-c2ccc(NC(=O)Cc3ccnc(NSC4CC4)n3)cc2)n1

nearest known ligand 0.51

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ CTPS1 P17812 20/20 0.51

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
SCHEMBL21387603 0.92 CTPS1 (0.49) CTPS1
SCHEMBL22758523 0.91 CTPS1 (0.54) CTPS1
SCHEMBL21387729 0.90 CTPS1 (0.46) CTPS1
SCHEMBL21373846 0.85 CTPS1 (0.69) CTPS1
SCHEMBL21387621 0.84 CTPS1 (0.58) CTPS1
SCHEMBL21387593 0.83 CTPS1 (0.60) CTPS1
SCHEMBL21387664 0.83 CTPS1 (0.57) CTPS1
SCHEMBL21387628 0.83 CTPS1 (0.72) CTPS1
SCHEMBL21387672 0.82 CTPS1 (0.60) CTPS1
SCHEMBL21387602 0.82 CTPS1 (0.61) 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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