SCHEMBL28016556

SCHEMBL28016556

CCCCC(=O)c1ccc(OCc2c(C)cccc2Cc2ccc(C(=O)O)cc2C(=O)O)c(C)c1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
THRA P10827 2/20 0.45
THRB P10828 1/20 0.45
PLA2G2A P14555 1/20 0.41
MRGPRX4 Q96LA9 6/20 0.41
PTPN11 Q06124 2/20 0.39
WDR5 P61964 1/20 0.38
LTB4R Q15722 1/20 0.38

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
SCHEMBL28024063 0.91 MRGPRX4 (0.43) MRGPRX4
SCHEMBL28821202 0.86 MRGPRX4 (0.46) MRGPRX4
SCHEMBL28024078 0.86 MRGPRX4 (0.44) MRGPRX4
SCHEMBL28024548 0.85 MRGPRX4 (0.43) MRGPRX4
SCHEMBL28024050 0.85 MRGPRX4 (0.46) MRGPRX4
SCHEMBL28016544 0.83 MAPT (0.41) MRGPRX4
SCHEMBL28024044 0.81 MRGPRX4 (0.41) MRGPRX4
SCHEMBL28024067 0.81 WDR5 (0.38) MRGPRX4PTPN11WDR5
SCHEMBL28024039 0.80 MRGPRX4 (0.42) MRGPRX4
SCHEMBL28020693 0.79 MRGPRX4 (0.39) MRGPRX4

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104884442-B Terazololine-one compound and application thereof 住友化学株式会社 2016-11-02 CN disclosed
CN-104684908-B Terazololine-one compound and the purposes as insecticide thereof 住友化学株式会社 2016-09-28 CN disclosed
CN-104884442-A Tetrazolinone compound and applications thereof SUMITOMO CHEMICAL CO 2015-09-02 CN disclosed
CN-104684908-A Tetrazolinone compounds and their use as pesticides SUMITOMO CHEMICAL CO 2015-06-03 CN disclosed