SCHEMBL28469797

SCHEMBL28469797

CCCC/C=C/CCCCCC.O=C(O)C(F)(F)C(F)(F)F

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.57
CES1 P23141 2/20 0.57
TERT O14746 3/20 0.55
PTPN1 P18031 3/20 0.55
PPARG P37231 3/20 0.55
PPARD Q03181 3/20 0.55
PPARA Q07869 3/20 0.55
TOP1 P11387 3/20 0.55
CYP1A2 P05177 2/20 0.55
MAPT P10636 2/20 0.55
CYP2C19 P33261 2/20 0.55
BLM P54132 2/20 0.55
HSD17B10 Q99714 2/20 0.55
FABP4 P15090 2/20 0.55
F7 P08709 2/20 0.55
F3 P13726 2/20 0.55
KMT2A Q03164 2/20 0.55
GMNN O75496 1/20 0.55
USP2 O75604 1/20 0.55
LMNA P02545 1/20 0.55

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
Trifluoroacetic Acid SCHEMBL28252551 0.87 FAAH (0.68) FAAHCES1TERTPTPN1PPARG
Trifluoroacetic Acid SCHEMBL28474921 0.87 FAAH (0.68) FAAHCES1TERTPTPN1PPARG
Trifluoroacetic Acid SCHEMBL28252550 0.87 FAAH (0.68) FAAHCES1TERTPTPN1PPARG
SCHEMBL28492683 0.84 FAAH (0.59) FAAHCES1TERTPTPN1PPARG
SCHEMBL29078879 0.79 LMNA (0.52) FAAHCES1PPARGPPARDPPARA
SCHEMBL9509757 0.79 FAAH (0.54) FAAHCES1TERTPTPN1PPARG
SCHEMBL9509752 0.79 FAAH (0.54) FAAHCES1TERTPTPN1PPARG
SCHEMBL9508952 0.79 FAAH (0.54) FAAHCES1TERTPTPN1PPARG
SCHEMBL9508957 0.79 FAAH (0.54) FAAHCES1TERTPTPN1PPARG
SCHEMBL28365282 0.79 FAAH (0.57) FAAHCES1TERTPTPN1PPARG

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112006020-A Efficient attractant for spodoptera frugiperda and application of efficient attractant 中国农业科学院植物保护研究所 2020-12-01 CN claimed
CN-111713497-A Efficient attractant for spodoptera frugiperda and application of efficient attractant 中国农业科学院植物保护研究所 2020-09-29 CN claimed
CN-112006020-A Efficient attractant for spodoptera frugiperda and application of efficient attractant 中国农业科学院植物保护研究所 2020-12-01 CN disclosed
CN-112006020-A Efficient attractant for spodoptera frugiperda and application of efficient attractant 中国农业科学院植物保护研究所 2020-12-01 CN disclosed
CN-111713497-A Efficient attractant for spodoptera frugiperda and application of efficient attractant 中国农业科学院植物保护研究所 2020-09-29 CN disclosed
CN-111713497-A Efficient attractant for spodoptera frugiperda and application of efficient attractant 中国农业科学院植物保护研究所 2020-09-29 CN disclosed