SCHEMBL9686069

SCHEMBL9686069

CCC(=O)c1ccc2c(c1)sc(=O)n2C

nearest known ligand 0.70

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 4/20 0.70
▸ ACHE P22303 1/20 0.57
▸ CNR2 P34972 3/20 0.46
▸ CNR1 P21554 2/20 0.46

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
SCHEMBL9686057 0.88 ACHE (0.61) SIGMAR1ACHECNR2CNR1
SCHEMBL8786318 0.87 ACHE (0.56) SIGMAR1ACHECNR2CNR1
SCHEMBL9484562 0.86 SIGMAR1 (0.69) SIGMAR1ACHECNR2CNR1
SCHEMBL7760497 0.84 ACHE (0.63) SIGMAR1ACHECNR2CNR1
SCHEMBL9483526 0.84 ACHE (0.63) SIGMAR1ACHE
SCHEMBL9484814 0.83 ACHE (0.58) SIGMAR1ACHECNR2CNR1
SCHEMBL9196384 0.83 ACHE (0.51) SIGMAR1ACHECNR2
SCHEMBL8620349 0.83 ACHE (0.54) SIGMAR1ACHE
SCHEMBL9684507 0.82 ACHE (0.60) SIGMAR1ACHECNR2CNR1
SCHEMBL9483563 0.82 ACHE (0.55) SIGMAR1ACHE

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-5084469-A Analgesics ADIR ET COMPAGNIE (FR) 1992-01-28 — — US disclosed
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