SCHEMBL31052896

SCHEMBL31052896

Cc1nccc(N[C@@H](CCC(C)(C)C)C(=O)O)n1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SORT1 Q99523 7/20 0.40
▸ GRN P28799 3/20 0.40
▸ PYGL P06737 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ PIK3C3 Q8NEB9 3/20 0.36
▸ ITGAV P06756 3/20 0.35
▸ ITGB6 P18564 3/20 0.35
▸ ITGB1 P05556 2/20 0.35
▸ ITGA4 P13612 2/20 0.35
▸ HRH4 Q9H3N8 2/20 0.34
▸ RIPK1 Q13546 1/20 0.34
▸ HRH3 Q9Y5N1 1/20 0.33
▸ ITGA5 P08648 2/20 0.33

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
SCHEMBL31052846 0.84 PTGDR (0.41) SORT1GRNPYGLCYP2C9ITGAV
SCHEMBL31052821 0.80 GRN (0.44) SORT1GRNPYGLCYP2C9ITGB1
SCHEMBL31052893 0.80 ITGAV (0.44) SORT1GRNPYGLCYP2C9ITGAV
SCHEMBL31052773 0.78 GRN (0.46) SORT1GRN
SCHEMBL31052797 0.76 ITGAV (0.42) SORT1GRNITGAVITGB6ITGB1
SCHEMBL31052861 0.76 GRN (0.42) SORT1GRN
SCHEMBL31052763 0.76 GRN (0.42) SORT1GRNPYGLCYP2C9ITGB1
SCHEMBL31052825 0.75 SORT1 (0.44) SORT1GRNPYGLCYP2C9ITGAV
SCHEMBL31052801 0.75 GRN (0.46) SORT1GRNPYGLCYP2C9RIPK1
SCHEMBL31052914 0.74 GRN (0.43) SORT1GRNPYGLCYP2C9ITGB1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4676914-A1 MODULATORS OF SORTILIN ACTIVITY Vesper Bio Aps (DK) 2026-01-14 — — EP claimed
WO-2024184469-A1 MODULATORS OF SORTILIN ACTIVITY VESPER BIO APS (DK) 2024-09-12 — — WO claimed
EP-4428121-A1 MODULATORS OF SORTILIN ACTIVITY Vesper Bio Aps (DK) 2024-09-11 — — EP claimed
EP-4676914-A1 MODULATORS OF SORTILIN ACTIVITY Vesper Bio Aps (DK) 2026-01-14 — — EP disclosed
WO-2024184469-A1 MODULATORS OF SORTILIN ACTIVITY VESPER BIO APS (DK) 2024-09-12 — — WO disclosed
EP-4428121-A1 MODULATORS OF SORTILIN ACTIVITY Vesper Bio Aps (DK) 2024-09-11 — — EP disclosed
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