SCHEMBL28024067

SCHEMBL28024067

CCCCOC(C=N)c1ccc(OCc2c(C)cccc2Cc2ccc(C(=O)O)cc2C(=O)O)c(C)c1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
WDR5 P61964 3/20 0.38
PTPN11 Q06124 2/20 0.36
MRGPRX4 Q96LA9 6/20 0.36
CYSLTR2 Q9NS75 2/20 0.35
CYSLTR1 Q9Y271 1/20 0.35

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
SCHEMBL28821025 0.86 FFAR1 (0.39) MRGPRX4
SCHEMBL28024517 0.83 MRGPRX4 (0.38) MRGPRX4
SCHEMBL28016556 0.81 THRA (0.45) WDR5PTPN11MRGPRX4
SCHEMBL28024548 0.78 MRGPRX4 (0.43) MRGPRX4
SCHEMBL28024063 0.78 MRGPRX4 (0.43) MRGPRX4
SCHEMBL28821202 0.78 MRGPRX4 (0.46) MRGPRX4
SCHEMBL28024050 0.77 MRGPRX4 (0.46) MRGPRX4
SCHEMBL28016544 0.75 MAPT (0.41) MRGPRX4
SCHEMBL28024078 0.74 MRGPRX4 (0.44) MRGPRX4
SCHEMBL28024044 0.74 MRGPRX4 (0.41) 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 2 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-104884442-A Tetrazolinone compound and applications thereof SUMITOMO CHEMICAL CO 2015-09-02 CN disclosed