SCHEMBL7219249

SCHEMBL7219249

CCC(C)OC(=O)C(C)C(C)C

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.41
FAAH O00519 1/20 0.34
ABCB1 P08183 1/20 0.34
TSHR P16473 2/20 0.31
CHRM2 P08172 2/20 0.31
CHRM4 P08173 2/20 0.31
CHRM1 P11229 2/20 0.31
TBXA2R P21731 1/20 0.31
ALDH1A1 P00352 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.30
CHRM5 P08912 1/20 0.30
CHRM3 P20309 1/20 0.30
LMNA P02545 1/20 0.30
CYP2C9 P11712 1/20 0.30
GALR3 O60755 1/20 0.30
BLM P54132 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
SCHEMBL2984338 1.00 MAPT (0.41) MAPTFAAHABCB1TSHRCHRM2
SCHEMBL2982464 1.00 MAPT (0.41) MAPTFAAHABCB1TSHRCHRM2
SCHEMBL1216964 0.80 MAPT (0.43) MAPTFAAHTSHRCHRM2CHRM4
SCHEMBL779893 0.80 MAPT (0.43) MAPTFAAHTSHRCHRM2CHRM4
SCHEMBL2980611 0.80 MAPT (0.43) MAPTFAAHTSHRCHRM2CHRM4
SCHEMBL8408942 0.79 MAPT (0.40) MAPTFAAHTSHRCHRM2CHRM4
SCHEMBL7223633 0.78 MAPT (0.42) MAPTFAAHTSHRCHRM2CHRM4
SCHEMBL2978632 0.78 MAPT (0.42) MAPTFAAHTSHRCHRM2CHRM4
SCHEMBL4439936 0.78 MAPT (0.42) MAPTFAAHTSHRCHRM2CHRM4
SCHEMBL702238 0.78 MAPT (0.42) MAPTFAAHTSHRCHRM2CHRM4

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
US-6667285-B1 Branched-chain carboxylic acid monoalkyl ester with outstanding hydrolytic stability NEW JAPAN CHEMICAL CO., LTD. (JP) 2003-12-23 US disclosed
EP-1225213-A1 LUBRICATING OIL FOR REFRIGERATOR, HYDRAULIC FLUID COMPOSITION FOR REFRIGERATOR AND METHOD FOR LUBRICATION OF REFRIGERATOR NEW JAPAN CHEMICAL CO.,LTD. (JP) 2002-07-24 EP disclosed
CN-85109197-A method for producing polymer 1986-05-10 CN disclosed