SCHEMBL1904422

SCHEMBL1904422

C[C@H]1[C@@H](c2ccccc2)CC(=O)N1CC(=O)O

nearest known ligand 0.79

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 1/20 0.79
▸ HSD17B2 P37059 9/20 0.43
▸ RIPK1 Q13546 2/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ ITGB1 P05556 1/20 0.38
▸ ITGA5 P08648 1/20 0.38

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
SCHEMBL12491341 1.00 SIGMAR1 (0.79) SIGMAR1HSD17B2RIPK1L3MBTL1ITGB1
SCHEMBL11993135 0.90 SIGMAR1 (0.77) SIGMAR1HSD17B2RIPK1
SCHEMBL1902449 0.88 SIGMAR1 (1.00) SIGMAR1HSD17B2RIPK1
SCHEMBL16134334 0.88 SIGMAR1 (1.00) SIGMAR1HSD17B2RIPK1
SCHEMBL12524313 0.88 SIGMAR1 (1.00) SIGMAR1HSD17B2RIPK1
SCHEMBL29897574 0.88 SIGMAR1 (1.00) SIGMAR1HSD17B2RIPK1
SCHEMBL1901822 0.88 SIGMAR1 (1.00) SIGMAR1HSD17B2RIPK1
SCHEMBL12490813 0.88 SIGMAR1 (1.00) SIGMAR1HSD17B2RIPK1
SCHEMBL12491087 0.84 SIGMAR1 (0.68) SIGMAR1
SCHEMBL1904928 0.84 SIGMAR1 (0.68) SIGMAR1

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
EP-2496555-A1 4R,5S-ENANTIOMER OF 2-(5-METHYL-2-OXO-4-PHENYL-PYRROLIDIN-1-YL)-ACETAMIDE WITH NOOTROPIC ACTIVITY Grindeks, A Joint Stock Company (LV) 2012-09-12 — — EP disclosed
WO-2011054888-A1 4R,5S-ENANTIOMER OF 2-(5-METHYL-2-OXO-4-PHENYL-PYRROLIDIN-1-YL)-ACETAMIDE WITH NOOTROPIC ACTIVITY GRINDEKS, A JOINT STOCK COMPANY (LV) 2011-05-12 — — WO disclosed
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