SCHEMBL28076901

SCHEMBL28076901

CCCCC/C=C\C/C=C\CCCCCCCC(=O)Oc1cc(C(C)C)ccc1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLM Q9NP87 1/20 0.49
POLK Q9UBT6 1/20 0.49
POLL Q9UGP5 1/20 0.49
POLH Q9Y253 1/20 0.49
ELANE P08246 1/20 0.47
HTR2A P28223 1/20 0.46
ALDH1A1 P00352 6/20 0.46
KDM4E B2RXH2 3/20 0.46
F7 P08709 3/20 0.46
F3 P13726 3/20 0.46
PPARG P37231 2/20 0.46
PPARD Q03181 2/20 0.46
PPARA Q07869 2/20 0.46
HPGD P15428 2/20 0.46
CYP3A4 P08684 2/20 0.46
ALOX15 P16050 2/20 0.46
TSHR P16473 2/20 0.46
HSD17B10 Q99714 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
FABP3 P05413 2/20 0.46

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
SCHEMBL28076675 0.97 FAAH (0.49) ALDH1A1HPGDFAAHMAPTCNR1
SCHEMBL17073986 0.91 TYR (0.52) ALOX15TYR
SCHEMBL28076679 0.91 TYR (0.52) ALOX15TYR
SCHEMBL17073982 0.91 TYR (0.52) ALOX15TYR
SCHEMBL249930 0.85 TYR (0.54) TYR
SCHEMBL15548722 0.80 ALOX15 (0.64) POLMPOLKPOLLPOLHKDM4E
SCHEMBL15557746 0.80 ALOX15 (0.64) POLMPOLKPOLLPOLHKDM4E
SCHEMBL249211 0.80 TYR (0.56) TYR
Linoleic Acid SCHEMBL28076903 0.80 PPARG (0.59) ALDH1A1KDM4EF7F3PPARG
SCHEMBL8006081 0.80 POLM (0.49) POLMPOLKPOLLPOLHELANE

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
CN-105753696-B A kind of Sheep's-parsley phenolic ester, feed addictive and feed 湖南晶天科技实业有限公司 2019-03-08 CN disclosed
CN-105753696-A Carvacrol ester, feed additive and feed 湖南晶天科技实业有限公司 2016-07-13 CN disclosed