SCHEMBL16627155

SCHEMBL16627155

COc1cccc(-n2nnn(C)c2=O)c1COc1ccc(-c2nn(C)c(C)c2C)cc1C

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
MRGPRX4 Q96LA9 1/20 0.32
KDM4E B2RXH2 7/20 0.32
HPGD P15428 5/20 0.32
ALDH1A1 P00352 4/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
KMT2A Q03164 3/20 0.32
MEN1 O00255 1/20 0.32
STAT3 P40763 1/20 0.32
STAT1 P42224 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
HTT P42858 1/20 0.32
PKM P14618 1/20 0.32
TSHR P16473 1/20 0.32
NPSR1 Q6W5P4 3/20 0.31
MAPT P10636 2/20 0.31
LMNA P02545 2/20 0.31
PPARG P37231 1/20 0.31
NCOA2 Q15596 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
SCHEMBL16911704 0.92 TP53 (0.33) TP53RXFP1MRGPRX4KDM4EHPGD
SCHEMBL16627180 0.92 MRGPRX4 (0.33) TP53RXFP1MRGPRX4KDM4EHPGD
SCHEMBL16911541 0.91 NR1H4 (0.32) TP53RXFP1MRGPRX4KDM4EHPGD
SCHEMBL16627154 0.91 TP53 (0.33) TP53RXFP1MRGPRX4KDM4EHPGD
SCHEMBL16910797 0.91 TP53 (0.33) TP53RXFP1MRGPRX4KDM4EHPGD
SCHEMBL16912017 0.91 OXTR (0.34) TP53RXFP1KDM4EHPGDALDH1A1
SCHEMBL16911218 0.89 MRGPRX4 (0.32) MRGPRX4
SCHEMBL16627181 0.89 MRGPRX4 (0.32) RXFP1MRGPRX4KDM4EHPGDKMT2A
SCHEMBL16911192 0.89 NR1H4 (0.37) MRGPRX4MAPT
SCHEMBL16910711 0.89 PTGER1 (0.35) MRGPRX4SMN1; SMN2MAPT

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
US-9828389-B2 Tetrazolinone compounds and their use as pesticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-11-28 US disclosed
US-9828389-B2 Tetrazolinone compounds and their use as pesticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-11-28 US disclosed
US-9828389-B2 Tetrazolinone compounds and their use as pesticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-11-28 US disclosed
EP-2900655-B1 TETRAZOLINONE COMPOUNDS AND THEIR USE AS PESTICIDES SUMITOMO CHEMICAL CO (JP) 2017-05-10 EP disclosed
EP-2900655-B1 TETRAZOLINONE COMPOUNDS AND THEIR USE AS PESTICIDES SUMITOMO CHEMICAL CO (JP) 2017-05-10 EP disclosed
US-20150203511-A1 TETRAZOLINONE COMPOUNDS AND THEIR USE AS PESTICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-07-23 US disclosed
US-20150203511-A1 TETRAZOLINONE COMPOUNDS AND THEIR USE AS PESTICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-07-23 US disclosed
US-20150203511-A1 TETRAZOLINONE COMPOUNDS AND THEIR USE AS PESTICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-07-23 US disclosed
WO-2015050040-A1 PLANT DISEASE CONTROL COMPOSITION AND USE THEREOF 住友化学株式会社 2015-04-09 WO disclosed
WO-2015050039-A1 PLANT DISEASE CONTROL COMPOSITION AND USE THEREOF 住友化学株式会社 2015-04-09 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-20150203511-A1 TETRAZOLINONE COMPOUNDS AND THEIR USE AS PESTICIDES CYCS, MT-CO3, CYP4F11 TP53 3329/4885RXFP1 836/4885MRGPRX4 1919/4885

“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.