SCHEMBL14175477

SCHEMBL14175477

O=C1CCC(C2CCC(CF)CC2)CC1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TLR4 O00206 2/20 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
SCHEMBL9908259 0.85
SCHEMBL14175445 0.85
SCHEMBL8428366 0.84 TLR4 (0.36) TLR4
SCHEMBL9234017 0.80 TRIM24 (0.41)
SCHEMBL8220510 0.80
SCHEMBL14175453 0.78
SCHEMBL8448821 0.77 TLR4 (0.36) TLR4
SCHEMBL6659962 0.77 TLR4 (0.36) TLR4
SCHEMBL510704 0.77 TRIM24 (0.44)
SCHEMBL1666553 0.74 TLR4 (0.51) 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
US-7385067-B2 Process for the preparation of compounds having a CF2O bridge MERCK PATENT GMBH (DE) 2008-06-10 US disclosed
US-7385067-B2 Process for the preparation of compounds having a CF2O bridge MERCK PATENT GMBH (DE) 2008-06-10 US disclosed