SCHEMBL8528618

SCHEMBL8528618

C=CC(C)CCC=C(C)COC(=O)Cl

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.33

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
SCHEMBL158258 0.87 ALOX15 (0.42) ALOX15TSHR
SCHEMBL10980197 0.87 ALOX15 (0.42) ALOX15TSHR
SCHEMBL8672011 0.84 ALOX15 (0.34) ALOX15TSHR
SCHEMBL8667280 0.84 TSHR (0.36) ALOX15TSHR
SCHEMBL3374536 0.82 ALOX15 (0.33) ALOX15TSHR
SCHEMBL7161103 0.82 ALOX15 (0.33) ALOX15TSHR
SCHEMBL7893228 0.82 ALOX15 (0.33) ALOX15TSHR
SCHEMBL7893230 0.82 TRPA1 (0.34) ALOX15TSHR
SCHEMBL8341380 0.81 ALOX15 (0.32) ALOX15TSHR
Bromide SCHEMBL8341298 0.80 ALOX15 (0.31) ALOX15

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-1998007683-A1 PROCESS FOR PREPARING β-KETOESTER PRO-FRAGRANCES THE PROCTER & GAMBLE COMPANY (US) 1998-02-26 WO claimed