SCHEMBL16627154

SCHEMBL16627154

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

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.33
RXFP1 Q9HBX9 1/20 0.33
ACLY P53396 1/20 0.33
EPHA2 P29317 1/20 0.33
KDR P35968 1/20 0.33
NR1H4 Q96RI1 2/20 0.32
MRGPRX4 Q96LA9 2/20 0.31
SMN1; SMN2 Q16637 4/20 0.31
KDM4E B2RXH2 3/20 0.31
HPGD P15428 3/20 0.31
ALDH1A1 P00352 2/20 0.31
KMT2A Q03164 2/20 0.31
MEN1 O00255 1/20 0.31
STAT3 P40763 1/20 0.31
STAT1 P42224 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
MDM4 O15151 3/20 0.31
MDM2 Q00987 3/20 0.31
HTT P42858 1/20 0.31
PKM P14618 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
SCHEMBL16910785 0.93 MAPT (0.33) RXFP1NR1H4MRGPRX4KDM4EHPGD
SCHEMBL16627153 0.92 NR1H4 (0.33) TP53RXFP1NR1H4MRGPRX4TDP1
SCHEMBL16627168 0.91 NR1H4 (0.37) EPHA2KDRNR1H4MRGPRX4MAPT
SCHEMBL16627155 0.91 TP53 (0.34) TP53RXFP1MRGPRX4SMN1; SMN2KDM4E
SCHEMBL16911704 0.90 TP53 (0.33) TP53RXFP1MRGPRX4SMN1; SMN2KDM4E
SCHEMBL16987242 0.90 BACE1 (0.33) NR1H4
SCHEMBL16627971 0.90 NR1H4 (0.32) RXFP1NR1H4MRGPRX4KDM4EHPGD
SCHEMBL16911097 0.90 NR1H4 (0.32) NR1H4MRGPRX4
SCHEMBL16911541 0.90 NR1H4 (0.32) TP53RXFP1NR1H4MRGPRX4SMN1; SMN2
SCHEMBL16911787 0.90 PTGER1 (0.35) NR1H4MRGPRX4SMN1; SMN2KMT2AMEN1

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-2015050039-A1 PLANT DISEASE CONTROL COMPOSITION AND USE THEREOF 住友化学株式会社 2015-04-09 WO disclosed
WO-2015050040-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 836/4885ACLY 2569/4885

“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.