SCHEMBL14201556

SCHEMBL14201556

CC1/C=C\CCCN(C2CC2)C[C@H](NC(=O)OC(C)(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H]1C(=O)NS(=O)(=O)C1CC1

nearest known ligand 0.42

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 1/20 0.31

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
SCHEMBL8352101 0.89 F2 (0.33) SCN9A
SCHEMBL17399729 0.82 CTSB (0.39) SCN9A
SCHEMBL8001796 0.80 F2 (0.33) —
SCHEMBL12820532 0.79 MEN1 (0.36) —
SCHEMBL8006720 0.78 TERF2 (0.33) —
SCHEMBL8209244 0.75 CTSB (0.39) —
SCHEMBL8104821 0.75 CTSB (0.39) —
SCHEMBL12468417 0.75 PSMB9 (0.36) —
SCHEMBL15849570 0.75 PSMB9 (0.36) —
SCHEMBL12467641 0.75 PSMB9 (0.36) —

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
WO-2008057871-A2 INHIBITORS OF HEPATITIS C VIRUS BRISTOL-MYERS SQUIBB COMPANY (US) 2008-05-15 — — WO disclosed
WO-2008057873-A2 INHIBITORS OF HEPATITIS C VIRUS BRISTOL-MYERS SQUIBB COMPANY (US) 2008-05-15 — — WO disclosed
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