SCHEMBL2721891

SCHEMBL2721891

COC(=O)COc1ccc(NC(=O)c2ccc(-c3nc4cc(Cl)c(Cl)cc4[nH]3)cc2)c(C(=O)O)c1

nearest known ligand 0.77

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PRSS12 P56730 20/20 0.77

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
SCHEMBL5538461 0.93 PRSS12 (0.67) PRSS12
SCHEMBL2723144 0.88 PRSS12 (0.69) PRSS12
SCHEMBL5541332 0.87 PRSS12 (1.00) PRSS12
SCHEMBL2724662 0.82 PRSS12 (0.85) PRSS12
SCHEMBL10243990 0.79 PRSS12 (0.72) PRSS12
SCHEMBL15717512 0.79 PRSS12 (1.00) PRSS12
SCHEMBL15717494 0.78 PRSS12 (1.00) PRSS12
SCHEMBL15283266 0.78 PRSS12 (0.69) PRSS12
SCHEMBL15717726 0.77 PRSS12 (1.00) PRSS12
SCHEMBL15717428 0.76 PRSS12 (1.00) PRSS12

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-2635559-A2 NEUROTRYPSIN INHIBITORS Neurotune AG (CH) 2013-09-11 — — EP disclosed
WO-2012059442-A2 NEUROTRYPSIN INHIBITORS NEUROTUNE AG (CH) 2012-05-10 — — WO disclosed
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