SCHEMBL19646233

SCHEMBL19646233

Cc1cc(O)c(Cl)cc1OCc1c(C)cccc1-n1nnn(C)c1=O

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 2/20 0.35
BDKRB2 P30411 11/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
MRGPRX4 Q96LA9 3/20 0.33
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31

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
SCHEMBL19646217 0.94 MRGPRX4 (0.35) BDKRB2MRGPRX4
SCHEMBL19646107 0.94 MRGPRX4 (0.35) SLC22A12BDKRB2SMN1; SMN2MRGPRX4CYP3A4
SCHEMBL19646189 0.91 MRGPRX4 (0.35) BDKRB2MRGPRX4
SCHEMBL19646115 0.91 MAPT (0.37) BDKRB2NPSR1MRGPRX4
SCHEMBL19646168 0.91 BDKRB2 (0.34) BDKRB2MRGPRX4
SCHEMBL19646193 0.91 BDKRB2 (0.33) BDKRB2MRGPRX4
SCHEMBL19646191 0.91 ADCYAP1R1 (0.35) BDKRB2
SCHEMBL16442873 0.91 SLC22A12 (0.37) SLC22A12NPSR1MRGPRX4CYP3A4CYP2C9
SCHEMBL16920761 0.91 SLC22A12 (0.35) SLC22A12BDKRB2SMN1; SMN2NPSR1MRGPRX4
SCHEMBL18427443 0.89 BDKRB2 (0.32) BDKRB2MRGPRX4

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
US-9828389-B2 Tetrazolinone compounds and their use as pesticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-11-28 US disclosed