SCHEMBL11409308

SCHEMBL11409308

C=CC(=O)N(C)[N+](C)(CCC)CC(O)CS(=O)(=O)[O-]

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BBOX1 O75936 1/20 0.30

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
Acrylamide SCHEMBL11409310 0.75 PSMD14 (0.33)
SCHEMBL24728108 0.72
SCHEMBL3890430 0.70 EPHX2 (0.31)
SCHEMBL24264508 0.66 SLC22A16 (0.52) BBOX1
SCHEMBL23542782 0.66 TSHR (0.37)
SCHEMBL26789442 0.65 PSMD14 (0.46) BBOX1
SCHEMBL9292923 0.65 BBOX1 (0.38) BBOX1
SCHEMBL31757094 0.65 SLC22A16 (0.32) BBOX1
SCHEMBL23201936 0.64 KMT2A (0.40) BBOX1
SCHEMBL11409313 0.64 KMT2A (0.40) BBOX1

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
US-4257907-A Disinfectant cleaning compositions MONSANTO COMPANY (US) 1981-03-24 US claimed
US-4252665-A PHENOL, 2-BENZYL-4-CHLORO- MONSANTO COMPANY (US) 1981-02-24 US claimed