SCHEMBL28835554

SCHEMBL28835554

Cc1cc(-c2nn(C)c(Cl)c2C)ccc1OCc1c(Cc2ccc(C(=O)O)cc2C(=O)O)cccc1S(C)(=O)=O

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 11/20 0.37
NR1H4 Q96RI1 3/20 0.34
VDR P11473 1/20 0.34
PTGER1 P34995 1/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.32
ACLY P53396 1/20 0.32
PPARA Q07869 1/20 0.32
PTGFR P43088 1/20 0.32
MCL1 Q07820 1/20 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
SCHEMBL28016504 0.91 MRGPRX4 (0.40) MRGPRX4NR1H4VDRPPARAPTGFR
SCHEMBL28016436 0.90 MRGPRX4 (0.40) MRGPRX4NR1H4VDRPPARAPTGFR
SCHEMBL28016505 0.87 MRGPRX4 (0.42) MRGPRX4PTGER1MCL1
SCHEMBL28016546 0.87 MRGPRX4 (0.37) MRGPRX4NR1H4VDRPTGER1PPARA
SCHEMBL28017136 0.87 MRGPRX4 (0.39) MRGPRX4PTGER1
SCHEMBL28020707 0.86 NR1H4 (0.39) MRGPRX4NR1H4VDR
SCHEMBL28016553 0.84 MRGPRX4 (0.49) MRGPRX4PTGER1MCL1
SCHEMBL28016447 0.83 MRGPRX4 (0.40) MRGPRX4NR1H4VDRPPARAMCL1
SCHEMBL28016520 0.82 MRGPRX4 (0.40) MRGPRX4NR1H4VDRPPARAMCL1
SCHEMBL28016502 0.80 MRGPRX4 (0.39) MRGPRX4NR1H4VDRPTGER1PTGFR

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
CN-104684909-B Terazololine-one compound and the purposes as insecticide thereof 住友化学株式会社 2016-10-12 CN disclosed