SCHEMBL11825966

SCHEMBL11825966

CC(=O)C1CCC(C)CC1=O

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TLR4 O00206 4/20 0.37
CRBN Q96SW2 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
SCHEMBL7741357 0.84 TLR4 (0.35) TLR4CRBN
SCHEMBL29595225 0.83 TLR4 (0.34) TLR4CRBN
SCHEMBL29595955 0.83 TLR4 (0.34) TLR4CRBN
SCHEMBL8083254 0.83 TLR4 (0.34) TLR4CRBN
SCHEMBL727954 0.81 TLR4 (0.33) TLR4
SCHEMBL30255209 0.81 TLR4 (0.33) TLR4
SCHEMBL10028630 0.81 TLR4 (0.33) TLR4
SCHEMBL17067705 0.81 TLR4 (0.33) TLR4
SCHEMBL17067707 0.81 TLR4 (0.33) TLR4
SCHEMBL17067706 0.81 TLR4 (0.33) TLR4

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
CN-103709163-A Xanthine derivative, preparation method thereof and uses thereof QILU PHARMACEUTICAL CO LTD 2014-04-09 CN disclosed
US-3931232-A 3-Alkyl xanthene compounds SMITHKLINE CORPORATION (US) 1976-01-06 US disclosed