SCHEMBL6327258

SCHEMBL6327258

Cn1nnn(-c2ccccc2C(=O)OC2=CC(=O)CCC2)c1=O

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.35
KMT2A Q03164 2/20 0.34
POLB P06746 2/20 0.34
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.33
MYC P01106 1/20 0.33
TSHR P16473 3/20 0.32
OPRM1 P35372 1/20 0.32
APEX1 P27695 1/20 0.31
RECQL P46063 1/20 0.31
CTDSP1 Q9GZU7 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL6324676 0.89 MAPT (0.34) MAPTKMT2A
SCHEMBL6331247 0.86 MAPT (0.32) MAPTKMT2AMEN1L3MBTL1
SCHEMBL6331222 0.81 HTT (0.43) MAPTSMN1; SMN2KMT2AMEN1LMNA
SCHEMBL6326292 0.78 KMT2A (0.36) MAPTSMN1; SMN2KMT2AMEN1LMNA
SCHEMBL6326309 0.78 ALDH1A1 (0.35) MAPTSMN1; SMN2KMT2APOLBTSHR
SCHEMBL6325427 0.78 MAPT (0.32) MAPTKMT2ALMNATSHR
SCHEMBL6334979 0.78 MAPT (0.32) MAPT
SCHEMBL6335008 0.78 UGCG (0.35) MAPTSMN1; SMN2KMT2APOLBMYC
SCHEMBL6328454 0.75 SIRT6 (0.36) MAPTKMT2APOLBMEN1LMNA
SCHEMBL6326681 0.74

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 7 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-20040102635-A1 Novel tetrazolinone derivatives YANAGI AKIHIKO (JP) 2004-05-27 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 (2 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-20040102635-A1 Novel tetrazolinone derivatives CBR1, CBR3, CYP1B1 MAPT 4318/4885SMN1; SMN2 4200/4885KMT2A 2267/4885
US-20040242895-A1 Novel tetrazolinone derivatives CBR3, CBR1, CYP1B1 MAPT 4327/4885SMN1; SMN2 4203/4885KMT2A 2263/4885

“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.