SCHEMBL28099127

SCHEMBL28099127

[CH2]CCCC(Br)CC(=O)O

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 1/20 0.35
TSHR P16473 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
GPR84 Q9NQS5 4/20 0.32
FOLH1 Q04609 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
GABRR1 P24046 2/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL4844058 0.79 LMNA (0.46) SLC22A6TSHRGPR84FOLH1GABRR1
SCHEMBL10659380 0.79 TSHR (0.41) SLC22A6TSHRTDP1GPR84FOLH1
SCHEMBL10474509 0.77 TSHR (0.39) SLC22A6TSHRTDP1GPR84FOLH1
SCHEMBL6464981 0.77 GPR84 (0.50) SLC22A6TSHRTDP1GPR84
SCHEMBL6465807 0.76 BLM (0.41) SLC22A6GPR84LMNA
SCHEMBL6829382 0.76 GPR84 (0.39) SLC22A6TSHRTDP1GPR84FOLH1
SCHEMBL6460749 0.76 BLM (0.45) SLC22A6GPR84LMNA
SCHEMBL6463034 0.76 GPR84 (0.59) SLC22A6TSHRTDP1GPR84
SCHEMBL9306682 0.74 TSHR (0.50) SLC22A6TSHRTDP1FOLH1SMN1; SMN2
SCHEMBL23829862 0.74 GPR84 (0.62) SLC22A6TSHRTDP1GPR84

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-105980354-B The manufacture method and its intermediate of pest control agent 组合化学工业株式会社 2018-04-13 CN disclosed
CN-105980354-A Method for producing harmful-organism control agent, and intermediate thereof 庵原化学工业株式会社 2016-09-28 CN disclosed