SCHEMBL31075191

SCHEMBL31075191

COC(=O)c1cnn(Cc2ccc(Cn3ccccc3=O)cc2)n1

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 19/20 0.47
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL31075254 0.85 KLKB1 (0.44) KLKB1
SCHEMBL19224705 0.84 AR (0.46) MEN1KMT2A
SCHEMBL19228569 0.79 CACNA1H (0.41) MEN1KMT2A
SCHEMBL31075214 0.77 ALDH1A1 (0.55) KLKB1
SCHEMBL16891601 0.75 PARP1 (0.47) KLKB1
SCHEMBL16487173 0.74 GAA (0.58) KLKB1MEN1KMT2A
SCHEMBL21190075 0.73 GAA (0.51) KLKB1
SCHEMBL31075184 0.72 KLKB1 (0.48) KLKB1
SCHEMBL17784845 0.72 KLKB1 (0.78) KLKB1
SCHEMBL9752787 0.71 POLB (0.63) KLKB1

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-4665330-A1 PLASMA KALLIKREIN INHIBITORS Merck Sharp & Dohme LLC (US) 2025-12-24 EP disclosed
WO-2024173196-A1 PLASMA KALLIKREIN INHIBITORS MERCK SHARP & DOHME LLC (US) 2024-08-22 WO disclosed