SCHEMBL28016512

SCHEMBL28016512

CCc1cccc(Cc2ccc(C(=O)O)cc2C(=O)O)c1COc1ccc(-c2cc(C)n(C)n2)cc1C

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 10/20 0.41
PTPN11 Q06124 1/20 0.36
LTB4R Q15722 1/20 0.35
LTB4R2 Q9NPC1 1/20 0.35
PTGER1 P34995 4/20 0.34
TTR P02766 1/20 0.33
PPARA Q07869 1/20 0.33

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
SCHEMBL28016439 0.94 MRGPRX4 (0.42) MRGPRX4PTPN11PTGER1
SCHEMBL28825558 0.90 MRGPRX4 (0.44) MRGPRX4PTGER1
SCHEMBL28020690 0.89 MRGPRX4 (0.38) MRGPRX4PTGER1TTR
SCHEMBL28016520 0.86 MRGPRX4 (0.40) MRGPRX4LTB4RLTB4R2TTRPPARA
SCHEMBL28017098 0.86 MRGPRX4 (0.41) MRGPRX4PTPN11LTB4RLTB4R2PTGER1
SCHEMBL28017247 0.85 MRGPRX4 (0.41) MRGPRX4PTPN11LTB4RLTB4R2PPARA
SCHEMBL28016462 0.85 MRGPRX4 (0.43) MRGPRX4PTPN11LTB4RLTB4R2PPARA
SCHEMBL28102143 0.85 MRGPRX4 (0.40) MRGPRX4PTPN11LTB4RLTB4R2PPARA
SCHEMBL28016436 0.85 MRGPRX4 (0.40) MRGPRX4LTB4RLTB4R2PPARA
SCHEMBL28017144 0.83 MRGPRX4 (0.39) MRGPRX4PTPN11LTB4RLTB4R2

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-104684908-A Tetrazolinone compounds and their use as pesticides SUMITOMO CHEMICAL CO 2015-06-03 CN disclosed