SCHEMBL6326739

SCHEMBL6326739

Cn1nccc1OC(=O)c1ccc(F)cc1Cn1nnn(C)c1=O

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
KDM5A P29375 8/20 0.36
KDM5B Q9UGL1 8/20 0.36
KDM4C Q9H3R0 7/20 0.36
ROCK2 O75116 4/20 0.35
P2RX7 Q99572 1/20 0.34
PTGER1 P34995 2/20 0.32
HTR2A P28223 1/20 0.32
KCNH2 Q12809 1/20 0.32
KDM2B Q8NHM5 2/20 0.31
KDM4A O75164 1/20 0.31
HPGD P15428 1/20 0.30
ALOX15 P16050 1/20 0.30
MAPK1 P28482 1/20 0.30
RAB9A P51151 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
SCHEMBL6860107 0.87 KDM4C (0.34) KDM5AKDM5BKDM4CPTGER1
SCHEMBL6328864 0.79 LMNA (0.33) KMT2AMEN1KDM5AKDM5BKDM4C
SCHEMBL6327440 0.78 KDM4C (0.33) KDM5AKDM5BKDM4CPTGER1
SCHEMBL6829938 0.77 RORC (0.30)
SCHEMBL6330868 0.68 GCK (0.32)
SCHEMBL6325932 0.68
SCHEMBL6326586 0.68 KDM4E (0.32) KMT2AMEN1
SCHEMBL6324111 0.68
SCHEMBL6333426 0.67
SCHEMBL6324670 0.66

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
US-6936570-B2 Tetrazolinone derivatives NIHON BAYER AGROCHEM, K.K. (JP) 2005-08-30 US disclosed
US-20040242895-A1 Novel tetrazolinone derivatives YANAGI AKIHIKO (JP) 2004-12-02 US disclosed
US-6790810-B2 Tetrazolinone derivatives NIHON BAYER AGROCHEM K.K. (JP) 2004-09-14 US disclosed
US-6624121-B1 Exemplified by 2-cyano-3-cyclopropyl-1-(3-((4-cyclopropyl-4,5-dihydro-5-oxo-1H-tetrazol-1 -yl)methyl)-2, 4-dichlorophenyl)propan-1,3-dione NIHON BAYER AGROCHEM K.K. (JP) 2003-09-23 US disclosed
EP-1208090-A1 HERBICIDALTETRAZOLINONE DERIVATIVES NIHON BAYER AGROCHEM K.K. (JP) 2002-05-29 EP disclosed
WO-2001010850-A1 HERBICIDAL TETRAZOLINONE DERIVATIVES NIHON BAYER AGROCHEM K.K. (DE) 2001-02-15 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-20040242895-A1 Novel tetrazolinone derivatives CBR3, CBR1, CYP1B1 KMT2A 2263/4885MEN1 3552/4885KDM5A 2426/4885

“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.