SCHEMBL7568910

SCHEMBL7568910

CC(C)OC(=O)C1(C)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 1/20 0.43
TSHR P16473 1/20 0.43
HCAR2 Q8TDS4 1/20 0.34
LMNA P02545 3/20 0.33
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
USP2 O75604 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MAPK1 P28482 1/20 0.33
NR4A1 P22736 1/20 0.33
CYP2D6 P10635 1/20 0.32
CA12 O43570 4/20 0.31
CA1 P00915 4/20 0.31
CA2 P00918 4/20 0.31
CA9 Q16790 4/20 0.31
CA7 P43166 3/20 0.31
CA14 Q9ULX7 3/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ACACB O00763 1/20 0.30
ADRA1A P35348 1/20 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
SCHEMBL10087893 0.93 FFAR3 (0.39) FFAR3TSHRHCAR2LMNAALDH1A1
SCHEMBL10087896 0.91 FFAR3 (0.37) FFAR3TSHRHCAR2ALDH1A1MAPK1
SCHEMBL3006849 0.81 TSHR (0.37) TSHRHCAR2LMNAALDH1A1KDM4E
SCHEMBL31020205 0.81 TSHR (0.37) TSHRHCAR2MAPK1
SCHEMBL21033826 0.80 TSHR (0.41) TSHRSMN1; SMN2
SCHEMBL9017781 0.79 TSHR (0.43) TSHRHCAR2LMNAALDH1A1KDM4E
SCHEMBL23396157 0.78 CYP2D6 (0.38) TSHRALDH1A1USP2CYP2D6SMN1; SMN2
SCHEMBL16882626 0.75 TSHR (0.40) TSHRHCAR2LMNAALDH1A1KDM4E
SCHEMBL10081209 0.75 TSHR (0.46) TSHRHCAR2LMNAALDH1A1KDM4E
SCHEMBL16086411 0.75 TSHR (0.40) TSHRHCAR2LMNAALDH1A1KDM4E

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-2002085294-A2 USE OF LOW MOLECULAR WEIGHT ACETAL, ALCOHOL, ACYLATED ALCOHOL AND ESTER COMPOUNDS TO BLOCK OR REDUCE ODOR OF CARBOXYLIC ACIDS SENOMYX, INC. (US) 2002-10-31 WO claimed
US-9150681-B2 Ethylene-based polymers and processes for the same DOW GLOBAL TECHNOLOGIES LLC (US) 2015-10-06 US disclosed
US-20130237678-A1 ETHYLENE-BASED POLYMERS AND PROCESSES FOR THE SAME DOW GLOBAL TECHNOLOGIES LLC (US) 2013-09-12 US disclosed