SCHEMBL16205960

SCHEMBL16205960

Cc1cccc(-n2nnn(C)c2=O)c1COc1cccc(-c2ccncc2)n1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.34
PDE10A Q9Y233 2/20 0.33
GSK3B P49841 3/20 0.32
FLT3 P36888 1/20 0.32
KDM4E B2RXH2 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CYP11B1 P15538 1/20 0.30
CYP11B2 P19099 1/20 0.30

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
SCHEMBL16205996 0.92 GABRA5 (0.36) HTR7PDE10ARAB9A
SCHEMBL16206095 0.91 HTR7 (0.34) HTR7SMN1; SMN2CYP11B1CYP11B2
SCHEMBL17614531 0.90 CYP2A6 (0.39) HTR7PDE10AKDM4ECYP11B1CYP11B2
SCHEMBL17614537 0.89 HTR7 (0.33) HTR7CYP11B1CYP11B2
SCHEMBL16206004 0.89 HTR7 (0.33) HTR7KDM4ERAB9ACYP11B1CYP11B2
SCHEMBL16205991 0.89 GABRA5 (0.35) HTR7KDM4ERAB9ACYP11B1CYP11B2
SCHEMBL16206101 0.89 CTSA (0.35) HTR7
SCHEMBL16205992 0.88 ALDH1A1 (0.36) HTR7PDE10AKDM4E
SCHEMBL17614571 0.87 GRM2 (0.35) HTR7SMN1; SMN2
SCHEMBL16206059 0.87 HTR7 (0.32) HTR7CYP11B1CYP11B2

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-2990404-B1 TETRAZOLINONE COMPOUND AND USE OF SAME SUMITOMO CHEMICAL CO (JP) 2020-05-27 EP disclosed
US-9867372-B2 Tetrazolinone compound and use of same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-01-16 US disclosed
US-9867372-B2 Tetrazolinone compound and use of same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-01-16 US disclosed
US-20160081339-A1 TETRAZOLINONE COMPOUND AND USE OF SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-03-24 US disclosed
US-20160081339-A1 TETRAZOLINONE COMPOUND AND USE OF SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-03-24 US disclosed
WO-2014175465-A1 TETRAZOLINONE COMPOUND AND USE OF SAME 住友化学株式会社 (JP) 2014-10-30 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-20160081339-A1 TETRAZOLINONE COMPOUND AND USE OF SAME MT-CO1, SOD1, MT-CO2 HTR7 2834/4885PDE10A 4037/4885GSK3B 2202/4885

“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.