SCHEMBL28020975

SCHEMBL28020975

Cc1cc(-n2ccc(C3CC3)n2)ccc1OCc1c(Cc2ccc(C(=O)O)cc2C(=O)O)cccc1C1CC1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 11/20 0.41
GLP1R P43220 2/20 0.34
NR1H4 Q96RI1 5/20 0.33
FPR2 P25090 1/20 0.33
TYMS P04818 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
SCHEMBL28017269 0.94 MRGPRX4 (0.42) MRGPRX4GLP1RNR1H4FPR2
SCHEMBL28020702 0.84 MRGPRX4 (0.39) MRGPRX4NR1H4
SCHEMBL28020688 0.82 MRGPRX4 (0.37) MRGPRX4GLP1RNR1H4
SCHEMBL28020690 0.82 MRGPRX4 (0.38) MRGPRX4GLP1RNR1H4
SCHEMBL28020979 0.82 NR1H4 (0.39) MRGPRX4GLP1RNR1H4
SCHEMBL28020693 0.81 MRGPRX4 (0.39) MRGPRX4NR1H4
SCHEMBL28108187 0.81 MRGPRX4 (0.37) MRGPRX4GLP1RNR1H4
SCHEMBL28108176 0.80 MRGPRX4 (0.38) MRGPRX4NR1H4FPR2
SCHEMBL28097578 0.79 NR1H4 (0.42) MRGPRX4NR1H4
SCHEMBL28024059 0.78 HIF1A (0.38) MRGPRX4NR1H4

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 2 patents. 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
CN-104684909-A Tetrazolinone compounds and their use as pesticides SUMITOMO CHEMICAL CO 2015-06-03 CN disclosed