SCHEMBL24832445

SCHEMBL24832445

CCOc1cncc(-c2ccc(NC(=O)C3(c4cccc(NSC5CC5)n4)CCOCC3)nc2)n1

nearest known ligand 0.61

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ CTPS1 P17812 20/20 0.61

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
SCHEMBL21392129 0.89 CTPS1 (0.73) CTPS1
SCHEMBL22924895 0.87 CTPS1 (0.68) CTPS1
SCHEMBL24832441 0.82 CTPS1 (0.68) CTPS1
SCHEMBL30518355 0.81 CTPS1 (0.69) CTPS1
SCHEMBL21381410 0.81 CTPS1 (0.69) CTPS1
SCHEMBL22749299 0.81 CTPS1 (0.71) CTPS1
SCHEMBL29142077 0.80 CTPS1 (0.70) CTPS1
SCHEMBL22758553 0.79 CTPS1 (0.64) CTPS1
SCHEMBL24832438 0.79 CTPS1 (0.58) CTPS1
SCHEMBL21381421 0.79 CTPS1 (0.86) 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-3870574-B1 AMINOPYRIMIDINE/PYRAZINE DERIVATIVES AS CTPS1 INHIBITORS STEP PHARMA S A S (FR) 2023-01-04 — — EP disclosed
Send feedback