SCHEMBL19646189

SCHEMBL19646189

CCc1cccc(-n2nnn(C)c2=O)c1COc1cc(Cl)c(O)cc1C

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 5/20 0.35
BDKRB2 P30411 10/20 0.33
P2RX7 Q99572 1/20 0.32
HSP90AA1 P07900 1/20 0.31
PTGER1 P34995 1/20 0.31
FFAR1 O14842 1/20 0.31
FFAR4 Q5NUL3 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
SCHEMBL19646149 0.92 MRGPRX4 (0.38) MRGPRX4P2RX7PTGER1
SCHEMBL19646217 0.91 MRGPRX4 (0.35) MRGPRX4BDKRB2
SCHEMBL19646233 0.91 SLC22A12 (0.35) MRGPRX4BDKRB2
SCHEMBL16920773 0.91 MRGPRX4 (0.34) MRGPRX4BDKRB2P2RX7
SCHEMBL19646111 0.91 HSP90AA1 (0.33) MRGPRX4HSP90AA1
SCHEMBL19646168 0.90 BDKRB2 (0.34) MRGPRX4BDKRB2P2RX7
SCHEMBL19646193 0.89 BDKRB2 (0.33) MRGPRX4BDKRB2PTGER1
SCHEMBL19646191 0.89 ADCYAP1R1 (0.35) BDKRB2
SCHEMBL19646215 0.89 MRGPRX4 (0.36) MRGPRX4P2RX7HSP90AA1PTGER1
SCHEMBL19646115 0.89 MAPT (0.37) MRGPRX4BDKRB2PTGER1

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