SCHEMBL1841306

SCHEMBL1841306

Cc1ncnc(C(=O)O)c1N.[NaH]

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.46
KMT2A Q03164 1/20 0.46
KMO O15229 5/20 0.44
TDP1 Q9NUW8 2/20 0.37
GABRP O00591 3/20 0.36
GABRD O14764 3/20 0.36
GABRA1 P14867 3/20 0.36
GABRB1 P18505 3/20 0.36
GABRG2 P18507 3/20 0.36
GABRB3 P28472 3/20 0.36
GABRA5 P31644 3/20 0.36
GABRA3 P34903 3/20 0.36
GABRA2 P47869 3/20 0.36
GABRB2 P47870 3/20 0.36
GABRA4 P48169 3/20 0.36
GABRE P78334 3/20 0.36
GABRA6 Q16445 3/20 0.36
GABRG1 Q8N1C3 3/20 0.36
GABRG3 Q99928 3/20 0.36
GABRQ Q9UN88 3/20 0.36

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
SCHEMBL27584076 0.98 KDM4E (0.47) KDM4EKMT2AKMOTDP1GABRP
SCHEMBL1841307 0.78 KDM4E (0.37) KDM4EKMT2AKMO
SCHEMBL1840938 0.77 NPSR1 (0.43) KDM4EKMT2APKMTP53HSD17B10
SCHEMBL13961021 0.77 KMO (0.47) KDM4EKMT2AKMOTDP1GABRP
SCHEMBL7763434 0.77 KMO (0.47) KDM4EKMT2AKMOPKMMYC
SCHEMBL31289904 0.75 KMO (0.44) KDM4EKMT2AKMOTDP1PKM
SCHEMBL13647306 0.75 KMO (0.44) KDM4EKMT2AKMOTDP1PKM
SCHEMBL21542758 0.73 FFAR2 (0.35) KDM4EKMT2A
SCHEMBL15976601 0.73 KMO (0.45) KDM4EKMT2AKMOTDP1GABRP
SCHEMBL31504047 0.73 KMO (0.38) KDM4EKMT2AKMOPKMMYC

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1373210-B1 HETEROCYCLIC DIAMIDE INVERTEBRATE PEST CONTROL AGENTS DU PONT (US) 2011-05-18 EP disclosed
US-7560564-B2 Heterocyclic diamide invertebrate pest control agents E.I. DU PONT DE NEMOURS AND COMPANY (US) 2009-07-14 US disclosed
US-20060205748-A1 Heterocyclic diamide invertebrate pest control agents ANNIS GARY D 2006-09-14 US disclosed
US-20040102324-A1 Heterocyclic diamide invertebrate pest control agents E.I. DU PONT DE NEMOURS AND COMPANY 2004-05-27 US 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-20060205748-A1 Heterocyclic diamide invertebrate pest control agents DDT, DBF4, C1S KDM4E 1378/4885KMT2A 1801/4885KMO 249/4885
US-20040102324-A1 Heterocyclic diamide invertebrate pest control agents DDT, DBF4, DDC KDM4E 835/4885KMT2A 1777/4885KMO 158/4885

“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.