SCHEMBL8426294

SCHEMBL8426294

C=C[n+]1ccn(CC)c1.COS(=O)(=O)[O-]

nearest known ligand 0.31

Known targets — ChEMBL curated mechanism

ACHECHRM1CHRM3

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ FDPS P14324 2/20 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
Sulfuric Acid SCHEMBL7997219 0.91 FDPS (0.34) FDPS
SCHEMBL27163411 0.89 FDPS (0.33) FDPS
SCHEMBL4648128 0.88 FDPS (0.30) FDPS
Sulfuric Acid SCHEMBL28760114 0.88 FDPS (0.35) FDPS
SCHEMBL5718742 0.83 — —
Hydrochloric Acid SCHEMBL5518177 0.82 FDPS (0.32) FDPS
Iodide SCHEMBL6853621 0.82 FDPS (0.32) FDPS
Bromide SCHEMBL2947343 0.82 FDPS (0.32) FDPS
SCHEMBL28760035 0.81 FDPS (0.34) FDPS
Acetic Acid SCHEMBL28760061 0.80 FDPS (0.36) FDPS

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-5962613-A CONTAINING A VINYLIMIDAZOLE; CLEANING COMPOUNDS BASF AKTIENGESELLSCHAFT (DE) 1999-10-05 — — US disclosed
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