SCHEMBL27377188

SCHEMBL27377188

N#Cc1ccc(-c2ccc(CC(C#N)NC(=O)C3CC4CCCC4N3)cc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CTSC P53634 20/20 1.00
▸ CTSK P43235 3/20 0.67
▸ KCNH2 Q12809 1/20 0.67

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
SCHEMBL30738919 1.00 CTSC (1.00) CTSCCTSKKCNH2
SCHEMBL27381736 0.90 CTSC (1.00) CTSCCTSKKCNH2
SCHEMBL27382213 0.86 CTSC (0.76) CTSCCTSK
SCHEMBL30738853 0.86 CTSC (0.76) CTSCCTSK
SCHEMBL27382085 0.86 CTSC (0.81) CTSCCTSKKCNH2
SCHEMBL27382090 0.86 CTSC (0.81) CTSCCTSKKCNH2
SCHEMBL27382088 0.86 CTSC (0.81) CTSCCTSKKCNH2
SCHEMBL2072228 0.81 CTSC (1.00) CTSCCTSKKCNH2
SCHEMBL30738922 0.80 CTSC (0.97) CTSCKCNH2
SCHEMBL27377178 0.80 CTSC (0.97) CTSCKCNH2

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
WO-2024026433-A2 NOVEL DPP1 INHIBITORS AND USES THEREOF INSMED INCORPORATED (US) 2024-02-01 — — WO disclosed
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