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Sugi Predict / Compounds / SCHEMBL8345771

SCHEMBL8345771

SCHEMBL8345771

CCN(C1CCCCC1)[C@@H](CC(=O)OC(C)(C)C)C(=O)N1CCCC[C@@H]1CCOC1CCN(C(=NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)CC1

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PRSS1 P07477 16/20 0.58
▸ F2 P00734 15/20 0.58

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
SCHEMBL8342619 0.91 PRSS1 (0.56) PRSS1F2
SCHEMBL8345833 0.91 PRSS1 (0.56) PRSS1F2
SCHEMBL8341828 0.91 PRSS1 (0.56) PRSS1F2
SCHEMBL8341809 0.91 PRSS1 (0.56) PRSS1F2
SCHEMBL8341856 0.91 PRSS1 (0.55) PRSS1F2
SCHEMBL8340442 0.87 PRSS1 (0.51) PRSS1F2
SCHEMBL8341812 0.86 PRSS1 (0.58) PRSS1F2
SCHEMBL8345142 0.85 PRSS1 (0.44) PRSS1F2
SCHEMBL8344277 0.85 PRSS1 (0.44) PRSS1F2
SCHEMBL8345139 0.85 PRSS1 (0.55) PRSS1F2

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
US-5917034-A Antithrombotic n-amidinopiperidine and benzamidine derivatives PFIZER INC. (US) 1999-06-29 — — US disclosed