SCHEMBL28688019

SCHEMBL28688019

CCCOC(=O)C(CC)(CC)CC(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.38
CYP4F2 P78329 1/20 0.38
CYP4A11 Q02928 1/20 0.38
LMNA P02545 2/20 0.36
ALDH1A1 P00352 3/20 0.34
CHRM1 P11229 3/20 0.33
HMGCR P04035 1/20 0.33
TBXA2R P21731 1/20 0.33
ADRA1A P35348 1/20 0.33
GAA P10253 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TSHR P16473 2/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
HIF1A Q16665 1/20 0.32
ESR1 P03372 1/20 0.32
SLC6A2 P23975 1/20 0.32
KDR P35968 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CHRM2 P08172 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
SCHEMBL27843702 0.89 ALDH1A1 (0.45) HCAR2CYP4F2CYP4A11ALDH1A1TSHR
SCHEMBL7704044 0.85 NAAA (0.47) HCAR2TSHR
SCHEMBL5482787 0.85 NAAA (0.47) HCAR2TSHR
SCHEMBL27908654 0.84 CYP4F2 (0.38) HCAR2CYP4F2CYP4A11LMNAALDH1A1
SCHEMBL20262480 0.83 CYP4F2 (0.53) HCAR2CYP4F2CYP4A11LMNAALDH1A1
SCHEMBL19690454 0.82 CA12 (0.35) CYP4F2CYP4A11LMNAALDH1A1GAA
SCHEMBL17617119 0.79 CYP4F2 (0.48) HCAR2CYP4F2CYP4A11LMNAALDH1A1
SCHEMBL26967727 0.79 CYP4F2 (0.44) HCAR2CYP4F2CYP4A11LMNAALDH1A1
SCHEMBL3426952 0.78 CYP4F2 (0.37) CYP4F2CYP4A11CHRM1HMGCRTBXA2R
SCHEMBL19690678 0.78 CYP4F2 (0.37) CYP4F2CYP4A11CHRM1HMGCRTBXA2R

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-113905612-A Arthropod control composition 弗门尼舍有限公司 2022-01-07 CN disclosed
CN-113873884-A Arthropod control composition 弗门尼舍有限公司 2021-12-31 CN disclosed