SCHEMBL19186816

SCHEMBL19186816

N#C[C@H](Cc1ccc(-c2ccc3c(c2)COC3)cc1)NC(=O)C1NC2CCC1C2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ CTSC P53634 20/20 1.00

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
SCHEMBL14822392 1.00 CTSC (1.00) CTSC
SCHEMBL14821979 0.86 CTSC (1.00) CTSC
SCHEMBL14821988 0.86 CTSC (1.00) CTSC
SCHEMBL19186938 0.86 CTSC (1.00) CTSC
SCHEMBL14822287 0.86 CTSC (1.00) CTSC
SCHEMBL14822289 0.85 CTSC (1.00) CTSC
SCHEMBL16622364 0.85 CTSC (1.00) CTSC
SCHEMBL14822294 0.85 CTSC (1.00) CTSC
SCHEMBL14822197 0.85 CTSC (1.00) CTSC
SCHEMBL14822298 0.85 CTSC (1.00) CTSC

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
EP-2758398-B1 SUBSTITUTED N- [1-CYANO-2- (PHENYL) ETHYL]-2-AZABICYCLO [2.2.1]HEPTANE-3-CARBOXAMIDE INHIBITORS OF CATHEPSIN C BOEHRINGER INGELHEIM INT (DE) 2017-08-02 — — EP disclosed
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