SCHEMBL16273632

SCHEMBL16273632

Cc1cc(OCc2ccccc2N=C=O)c(C)cc1O

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.37
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
FFAR4 Q5NUL3 5/20 0.36
FFAR1 O14842 3/20 0.36
TRPA1 O75762 1/20 0.34
CD274 Q9NZQ7 2/20 0.33
CDK4 P11802 1/20 0.33
CCND1 P24385 1/20 0.33
MRGPRX4 Q96LA9 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRB2 P47870 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
SCHEMBL17616618 0.91 CYP3A4 (0.42) CYP3A4PTGDR2MAPTRAB9ANPSR1
SCHEMBL16273628 0.89 MRGPRX4 (0.40) CYP3A4PTGDR2MAPTRAB9AFFAR4
SCHEMBL16273615 0.89 MRGPRX4 (0.39) CYP3A4PTGDR2MAPTRAB9ANPSR1
SCHEMBL16273627 0.89 FFAR4 (0.41) CYP3A4PTGDR2MAPTRAB9AFFAR4
SCHEMBL16273619 0.86 FFAR4 (0.41) CYP3A4FFAR4FFAR1CD274MRGPRX4
SCHEMBL17616590 0.83 MRGPRX4 (0.39) CYP3A4PTGDR2MAPTFFAR4FFAR1
SCHEMBL17616598 0.83 FFAR4 (0.41) CYP3A4PTGDR2MAPTRAB9ANPSR1
SCHEMBL17616643 0.82 L3MBTL1 (0.43) CYP3A4MAPTRAB9AFFAR4FFAR1
SCHEMBL17616649 0.81 FFAR1 (0.39) CYP3A4PTGDR2MAPTRAB9AFFAR4
SCHEMBL17806117 0.79 CYP3A4 (0.40) CYP3A4PTGDR2MAPTFFAR4FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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