SCHEMBL28897337

SCHEMBL28897337

C=CCCCC/C=C\CCCC

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.78
ALDH1A1 P00352 1/20 0.78
FAAH O00519 2/20 0.48
TRPV1 Q8NER1 2/20 0.48
F7 P08709 1/20 0.46
F3 P13726 1/20 0.46
GMNN O75496 1/20 0.41
USP2 O75604 1/20 0.41
LMNA P02545 1/20 0.41
CYP1A2 P05177 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
CYP2C9 P11712 1/20 0.41
ALOX15 P16050 1/20 0.41
APEX1 P27695 1/20 0.41
CYP2C19 P33261 1/20 0.41
RECQL P46063 1/20 0.41
BLM P54132 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL9187603 1.00 TSHR (0.78) TSHRALDH1A1FAAHTRPV1F7
SCHEMBL7856670 1.00 TSHR (0.78) TSHRALDH1A1FAAHTRPV1F7
SCHEMBL1060985 0.97 TSHR (0.75) TSHRALDH1A1FAAHTRPV1F7
SCHEMBL5489696 0.97 TSHR (0.75) TSHRALDH1A1FAAHTRPV1F7
SCHEMBL6720067 0.97 TSHR (0.75) TSHRALDH1A1FAAHTRPV1F7
SCHEMBL25182434 0.97 TSHR (0.74) TSHRALDH1A1FAAHTRPV1F7
SCHEMBL6432087 0.97 TSHR (0.75) TSHRALDH1A1FAAHTRPV1F7
SCHEMBL6272868 0.97 TSHR (0.75) TSHRALDH1A1FAAHTRPV1F7
SCHEMBL7099079 0.97 TSHR (0.75) TSHRALDH1A1FAAHTRPV1F7
SCHEMBL6480109 0.97 TSHR (0.75) TSHRALDH1A1FAAHTRPV1F7

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-111466397-B Composition for preventing and treating silvery spodoptera and application thereof 中国农业科学院植物保护研究所 2022-02-15 CN claimed
CN-111466397-A Composition for preventing and treating silvery spodoptera and application thereof 中国农业科学院植物保护研究所 2020-07-31 CN claimed
CN-111466397-B Composition for preventing and treating silvery spodoptera and application thereof 中国农业科学院植物保护研究所 2022-02-15 CN disclosed
CN-111466397-B Composition for preventing and treating silvery spodoptera and application thereof 中国农业科学院植物保护研究所 2022-02-15 CN disclosed
CN-111466397-A Composition for preventing and treating silvery spodoptera and application thereof 中国农业科学院植物保护研究所 2020-07-31 CN disclosed
CN-111466397-A Composition for preventing and treating silvery spodoptera and application thereof 中国农业科学院植物保护研究所 2020-07-31 CN disclosed