SCHEMBL8892646

SCHEMBL8892646

[C]c1ccc2c(c1C)S(=O)(=O)CCC2(C)C

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LOX P28300 1/20 0.33
HDAC4 P56524 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
SCHEMBL8892644 0.85 KDM4E (0.38) LOXHDAC4
SCHEMBL6981388 0.78 RXRA (0.38)
SCHEMBL7675064 0.75 CYP3A4 (0.36) HDAC4
SCHEMBL6972568 0.74 HDAC4 (0.31) HDAC4
SCHEMBL7617939 0.70 SPR (0.33)
SCHEMBL20921325 0.65 LOX (0.41) LOXHDAC4
SCHEMBL2599798 0.59 ALDH1A1 (0.33) LOX
SCHEMBL2599788 0.59 RXRA (0.44)
SCHEMBL670268 0.58 LOX (0.37) LOX
SCHEMBL12715259 0.58 RXRA (0.38) LOX

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
WO-1997019076-A1 ISOXAZOLE-4-YL-BENZOYL DERIVATIVES AND THE USE THEREOF AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1997-05-29 WO disclosed