SCHEMBL8997328

SCHEMBL8997328

C[n+]1c2ccccc2c(C(=O)[O-])c2ccccc21.O=S(=O)(O)F

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACHE P22303 16/20 0.42
USP2 O75604 1/20 0.34

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
SCHEMBL8495949 0.90 ACHE (0.50) ACHEUSP2
SCHEMBL31163696 0.90 ACHE (0.50) ACHEUSP2
Trifluoromethanesulfonic Acid SCHEMBL8332149 0.89 ACHE (0.40) ACHEUSP2
SCHEMBL8975323 0.83 DHODH (0.40) ACHE
SCHEMBL8997331 0.81 ACHE (0.44) ACHE
SCHEMBL8997349 0.81 ACHE (0.44) ACHE
SCHEMBL8439431 0.79
SCHEMBL9034881 0.78 ACHE (0.38) ACHE
SCHEMBL8029948 0.77 ACHE (0.36) ACHE
SCHEMBL9669290 0.76 ACHE (0.38) ACHE

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-0729030-A1 Chemiluminescence method KYOTO DAIICHI KAGAKU CO., LTD. (JP) 1996-08-28 EP disclosed