SCHEMBL21449941

SCHEMBL21449941

OCC1C(c2ccc(F)c(C(F)(F)F)c2)C1(Cl)Cl

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 5/20 0.34
ADRA2A P08913 1/20 0.34
CHRNB2 P17787 1/20 0.34
ADRA2C P18825 1/20 0.34
CHRNB4 P30926 1/20 0.34
CHRNA3 P32297 1/20 0.34
CHRNA7 P36544 1/20 0.34
CHRNA4 P43681 1/20 0.34
TMEM97 Q5BJF2 1/20 0.34
TAS1R3 Q7RTX0 1/20 0.33
TAS1R1 Q7RTX1 1/20 0.33
TAS1R2 Q8TE23 1/20 0.33
KDM1A O60341 1/20 0.32
KIF11 P52732 1/20 0.32
ABCC9 O60706 2/20 0.32
ABCC8 Q09428 2/20 0.32
KCNJ11 Q14654 2/20 0.32
KCNJ8 Q15842 2/20 0.32
SLC6A4 P31645 1/20 0.32
PTPN7 P35236 2/20 0.32

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
SCHEMBL21587433 0.80 SLC6A4 (0.36) SLC6A4
SCHEMBL24281941 0.79 SLC9A1 (0.31)
SCHEMBL29414010 0.75 NOTUM (0.40) ARADRA2ACHRNB2ADRA2CCHRNB4
SCHEMBL21021644 0.75 ADRA2A (0.39) ARADRA2ACHRNB2ADRA2CCHRNB4
SCHEMBL18146735 0.75 NOTUM (0.40) ARADRA2ACHRNB2ADRA2CCHRNB4
SCHEMBL18146734 0.75 NOTUM (0.40) ARADRA2ACHRNB2ADRA2CCHRNB4
SCHEMBL20901183 0.75 NOTUM (0.40) ARADRA2ACHRNB2ADRA2CCHRNB4
SCHEMBL18146739 0.75 NOTUM (0.40) ARADRA2ACHRNB2ADRA2CCHRNB4
SCHEMBL30799673 0.75 ADRA2A (0.38) ARADRA2ACHRNB2ADRA2CCHRNB4
SCHEMBL23961571 0.75 ADRA2A (0.38) ARADRA2ACHRNB2ADRA2CCHRNB4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019194982-A1 MOLECULES HAVING PESTICIDAL UTILITY, COMPOSITIONS AND PEST CONTROLLING PROCESS RELATED THERETO DOW AGROSCIENCES LLC (US) 2019-10-10 WO disclosed