SCHEMBL4778857

SCHEMBL4778857

CC(C)=CC(C)CCC(C)CO

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.44
ALDH1A1 P00352 1/20 0.35
ALOX15 P16050 1/20 0.35

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
SCHEMBL4776844 0.77 ALDH1A1 (0.30) ALDH1A1ALOX15
SCHEMBL28985940 0.77
SCHEMBL4247960 0.76
SCHEMBL14113732 0.76 TSHR (0.69) TSHRALDH1A1ALOX15
SCHEMBL168774 0.76 TSHR (0.69) TSHRALDH1A1ALOX15
SCHEMBL19694297 0.75 TSHR (0.32) TSHRALDH1A1
SCHEMBL4780044 0.73 ALOX15 (0.33) TSHRALOX15
SCHEMBL11376220 0.73 TSHR (0.46) TSHR
SCHEMBL17953124 0.73 TSHR (0.65) TSHRALDH1A1ALOX15
SCHEMBL1856831 0.72

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008009841-A1 NEW ODORIFEROUS COMPOUNDS, SYNTHESIS PROCESS AND USES THEREOF V. MANE FILS (FR) 2008-01-24 WO claimed
WO-2008009841-A1 NEW ODORIFEROUS COMPOUNDS, SYNTHESIS PROCESS AND USES THEREOF V. MANE FILS (FR) 2008-01-24 WO disclosed
WO-2008009841-A1 NEW ODORIFEROUS COMPOUNDS, SYNTHESIS PROCESS AND USES THEREOF V. MANE FILS (FR) 2008-01-24 WO disclosed