SCHEMBL16273684

SCHEMBL16273684

Cc1cc(-c2nn(C)c(C(=O)O)c2C)ccc1OCc1ccccc1-n1nnn(C)c1=O

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 4/20 0.38
CD274 Q9NZQ7 8/20 0.36
FFAR4 Q5NUL3 2/20 0.35
FFAR1 O14842 1/20 0.35
S1PR1 P21453 1/20 0.34
S1PR5 Q9H228 1/20 0.34
HPGD P15428 1/20 0.34
P2RX3 P56373 1/20 0.34
PSD A5PKW4 1/20 0.34
PTGER1 P34995 2/20 0.34

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
SCHEMBL16273688 0.93 MRGPRX4 (0.35) MRGPRX4CD274FFAR4FFAR1S1PR1
SCHEMBL16273667 0.93 MRGPRX4 (0.35) MRGPRX4CD274FFAR4FFAR1S1PR1
SCHEMBL16273679 0.91 HPGD (0.36) MRGPRX4CD274HPGDP2RX3PSD
SCHEMBL17600083 0.91 MRGPRX4 (0.36) MRGPRX4CD274FFAR4FFAR1S1PR1
SCHEMBL16910996 0.90 MRGPRX4 (0.36) MRGPRX4CD274HPGDP2RX3PSD
SCHEMBL19987549 0.89 HPGD (0.35) MRGPRX4CD274FFAR4FFAR1S1PR1
SCHEMBL16627171 0.89 MRGPRX4 (0.37) MRGPRX4HPGDP2RX3PSDPTGER1
SCHEMBL16273621 0.87 MRGPRX4 (0.33) MRGPRX4CD274FFAR4FFAR1HPGD
SCHEMBL17600246 0.87 HPGD (0.33) MRGPRX4CD274S1PR1S1PR5HPGD
SCHEMBL17600282 0.86 KDM4E (0.34) MRGPRX4CD274HPGDPTGER1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3006440-B1 TETRAZOLINONE COMPOUND AND APPLICATION OF SAME SUMITOMO CHEMICAL CO (JP) 2018-03-21 EP disclosed
US-9675072-B2 Tetrazolinone compound and application of same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-06-13 US disclosed
US-9675072-B2 Tetrazolinone compound and application of same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-06-13 US disclosed
US-9675072-B2 Tetrazolinone compound and application of same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-06-13 US disclosed
EP-3006440-A1 TETRAZOLINONE COMPOUND AND APPLICATION OF SAME Sumitomo Chemical Company Limited (JP) 2016-04-13 EP disclosed
EP-3006440-A1 TETRAZOLINONE COMPOUND AND APPLICATION OF SAME Sumitomo Chemical Company Limited (JP) 2016-04-13 EP disclosed
US-20160081340-A1 TETRAZOLINONE COMPOUND AND APPLICATION OF SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-03-24 US disclosed
US-20160081340-A1 TETRAZOLINONE COMPOUND AND APPLICATION OF SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-03-24 US disclosed
US-20160081340-A1 TETRAZOLINONE COMPOUND AND APPLICATION OF SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-03-24 US disclosed
WO-2014192953-A1 TETRAZOLINONE COMPOUND AND APPLICATION OF SAME 住友化学株式会社 (JP) 2014-12-04 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160081340-A1 TETRAZOLINONE COMPOUND AND APPLICATION OF SAME CYP2E1, MT-CO2, CASP3 MRGPRX4 2185/4885CD274 2810/4885FFAR4 2020/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.