SCHEMBL7665181

SCHEMBL7665181

CCC#CCCOC(=O)C(C)=O

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.34
TSHR P16473 3/20 0.33
GLO1 Q04760 1/20 0.32
ALDH1A1 P00352 3/20 0.31
LMNA P02545 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL28408122 0.89 THRB (0.33) THRBTSHRALDH1A1
SCHEMBL16649222 0.83 GRIK1 (0.31) THRB
SCHEMBL10901295 0.83 ALDH1A1 (0.48) TSHRALDH1A1LMNAHSD17B10
SCHEMBL7645551 0.80 ALDH1A1 (0.42) ALDH1A1
SCHEMBL7645554 0.78 PTPN7 (0.32) ALDH1A1
SCHEMBL28413680 0.76 TSHR (0.36) THRBTSHRALDH1A1
SCHEMBL12088001 0.74 THRB (0.46) THRBTSHRGLO1ALDH1A1LMNA
SCHEMBL10900385 0.73 DGKA (0.44) THRBALDH1A1
SCHEMBL12445284 0.72 ALDH1A1 (0.50) TSHRALDH1A1LMNAHSD17B10
SCHEMBL106813 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6492323-B2 CONTROLLED RELEASE UPON EXPOSURE TO LIGHT FIRMENICH SA (CH) 2002-12-10 US disclosed
US-6218355-B1 FOR RELEASING FRAGRANT COMPOUND OR COMPOUNDS IN A CONTROLLED MANNER, MAINTAINING A DESIRED SMELL OVER A PROLONGED PERIOD OF TIME FIRMENICH SA (CH) 2001-04-17 US disclosed