SCHEMBL28596274

SCHEMBL28596274

C=CC1OC1CCCCC=CCCCCCCCC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.45
ALOX5 P09917 1/20 0.45
FAAH O00519 3/20 0.41
TRPV1 Q8NER1 1/20 0.41
MAPT P10636 3/20 0.37
TERT O14746 3/20 0.37
BLM P54132 2/20 0.37
HSD17B10 Q99714 2/20 0.37
FABP4 P15090 2/20 0.37
GMNN O75496 1/20 0.37
USP2 O75604 1/20 0.37
LMNA P02545 1/20 0.37
CYP1A2 P05177 1/20 0.37
POLB P06746 1/20 0.37
CYP2C9 P11712 1/20 0.37
ALOX15 P16050 1/20 0.37
APEX1 P27695 1/20 0.37
CYP2C19 P33261 1/20 0.37
RECQL P46063 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL4447205 0.91 TSHR (0.43) TSHRALOX5POLB
SCHEMBL13863985 0.91 TSHR (0.43) TSHRALOX5POLB
SCHEMBL4447204 0.91 TSHR (0.43) TSHRALOX5POLB
SCHEMBL8782117 0.91 TSHR (0.43) TSHRALOX5POLB
SCHEMBL4447210 0.91 TSHR (0.43) TSHRALOX5POLB
SCHEMBL7033921 0.89 TSHR (0.39) TSHRALOX5POLB
SCHEMBL15093177 0.89 TSHR (0.39) TSHRALOX5POLB
SCHEMBL814218 0.83
SCHEMBL22804724 0.81 FAAH (0.50) FAAHTRPV1MAPTTERTBLM
SCHEMBL5177020 0.81 TSHR (0.39) TSHRMAPTUSP2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111406744-B General sex pheromone composition for ectropis obliqua and tea caterpillar, sex attractant, and preparation method and application thereof 中国农业科学院茶叶研究所 2021-06-25 CN disclosed
CN-111406744-B General sex pheromone composition for ectropis obliqua and tea caterpillar, sex attractant, and preparation method and application thereof 中国农业科学院茶叶研究所 2021-06-25 CN disclosed
CN-111406744-A General sex pheromone composition for ectropis obliqua and tea caterpillar, sex attractant, and preparation method and application thereof 中国农业科学院茶叶研究所 2020-07-14 CN disclosed
CN-111406744-A General sex pheromone composition for ectropis obliqua and tea caterpillar, sex attractant, and preparation method and application thereof 中国农业科学院茶叶研究所 2020-07-14 CN disclosed