SCHEMBL19646220

SCHEMBL19646220

Cc1cc(OCc2c(Br)cccc2-n2nnn(C)c2=O)c(C)cc1O

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 1/20 0.32
SLC22A12 Q96S37 1/20 0.31
FFAR4 Q5NUL3 1/20 0.30
JAK2 O60674 1/20 0.30
BTK Q06187 1/20 0.30
MAPT P10636 1/20 0.30
RAB9A P51151 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
MRGPRX4 Q96LA9 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
SCHEMBL16920818 0.92 MAPT (0.32) PTGER1SLC22A12FFAR4JAK2BTK
SCHEMBL19646171 0.91 MAPK14 (0.32) PTGER1MRGPRX4
SCHEMBL19646193 0.91 BDKRB2 (0.33) PTGER1MRGPRX4
SCHEMBL16442873 0.91 SLC22A12 (0.37) PTGER1SLC22A12MAPTRAB9ANPSR1
SCHEMBL15851147 0.89 FFAR4 (0.35) PTGER1FFAR4JAK2BTKMRGPRX4
SCHEMBL19646153 0.88 PTGER1 (0.37) PTGER1SLC22A12MAPTRAB9AMRGPRX4
SCHEMBL19646118 0.88 MRGPRX4 (0.35) SLC22A12MAPTRAB9AMRGPRX4
SCHEMBL19646111 0.88 HSP90AA1 (0.33) SLC22A12MAPTRAB9ANPSR1MRGPRX4
SCHEMBL19646109 0.88 ATP4A (0.34) SLC22A12JAK2BTKMAPTMRGPRX4
SCHEMBL19646166 0.88 MAPT (0.35) SLC22A12MAPTMRGPRX4

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