SCHEMBL8025698

SCHEMBL8025698

CCCCC(CC)(CCC)OO

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32
FDPS P14324 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
SCHEMBL28701284 0.95 TSHR (0.35) TSHRFDPS
SCHEMBL8026009 0.90 FDPS (0.33) TSHRFDPS
SCHEMBL28586640 0.78 GGPS1 (0.41) TSHRFDPS
SCHEMBL3481532 0.76
Bicarbonate SCHEMBL989024 0.76 CES2 (0.38) TSHR
SCHEMBL28618692 0.74 TSHR (0.33) TSHRFDPS
SCHEMBL28714061 0.74 TSHR (0.33) TSHRFDPS
SCHEMBL5909161 0.73 SMPD1 (0.50) FDPS
SCHEMBL6663684 0.73
SCHEMBL11757198 0.72 TSHR (0.32) TSHRFDPS

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-0982395-A1 Hydroperoxides as perfumes Dragoco Gerberding & Co Aktiengesellschaft (DE) 2000-03-01 EP disclosed