SCHEMBL16273624

SCHEMBL16273624

Cc1cc(O)cc(F)c1OCc1ccccc1N=C=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.36
FFAR1 O14842 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34
THRB P10828 2/20 0.33
THRA P10827 1/20 0.33
MAOB P27338 3/20 0.33
TRPA1 O75762 1/20 0.33
MEN1 O00255 5/20 0.32
KMT2A Q03164 5/20 0.32
MAPT P10636 5/20 0.31
POLB P06746 1/20 0.31
MAPK1 P28482 1/20 0.31
ALDH1A1 P00352 3/20 0.31
GAA P10253 3/20 0.31
L3MBTL1 Q9Y468 3/20 0.31
KDM4E B2RXH2 2/20 0.31
GABRA1 P14867 1/20 0.31
GABRB2 P47870 1/20 0.31
LMNA P02545 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL17616623 0.89 CYP3A4 (0.36) CYP3A4FFAR1FFAR4THRBTHRA
SCHEMBL17806116 0.82 CYP3A4 (0.41) CYP3A4FFAR1FFAR4THRBTHRA
SCHEMBL16273615 0.80 MRGPRX4 (0.39) CYP3A4FFAR1FFAR4THRBMEN1
SCHEMBL16273619 0.79 FFAR4 (0.41) CYP3A4FFAR1FFAR4
SCHEMBL17616590 0.79 MRGPRX4 (0.39) CYP3A4FFAR1FFAR4TRPA1MAPT
SCHEMBL16273694 0.77 FFAR1 (0.36) FFAR1FFAR4THRBTHRAMAOB
SCHEMBL16273661 0.76 TP53 (0.47) FFAR1FFAR4THRBTHRAALDH1A1
SCHEMBL16273632 0.75 CYP3A4 (0.37) CYP3A4FFAR1FFAR4TRPA1MAPT
SCHEMBL17616618 0.75 CYP3A4 (0.42) CYP3A4FFAR1FFAR4MAOBTRPA1
SCHEMBL17806117 0.74 CYP3A4 (0.40) CYP3A4FFAR1FFAR4TRPA1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3029030-B1 TETRAZOLINONE COMPOUND, AND USE THEREFOR SUMITOMO CHEMICAL CO (JP) 2019-09-04 EP disclosed
US-9675072-B2 Tetrazolinone compound and application of same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-06-13 US disclosed
EP-3029030-A1 TETRAZOLINONE COMPOUND, AND USE THEREFOR Sumitomo Chemical Company, Limited (JP) 2016-06-08 EP disclosed
EP-3006440-A1 TETRAZOLINONE COMPOUND AND APPLICATION OF SAME Sumitomo Chemical Company Limited (JP) 2016-04-13 EP disclosed
WO-2015016373-A1 TETRAZOLINONE COMPOUND, AND USE THEREFOR 住友化学株式会社 (JP) 2015-02-05 WO disclosed
WO-2014192953-A1 TETRAZOLINONE COMPOUND AND APPLICATION OF SAME 住友化学株式会社 (JP) 2014-12-04 WO disclosed