SCHEMBL1840938

SCHEMBL1840938

COC(=O)c1ncnc(C)c1N

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.37
KDM4E B2RXH2 5/20 0.36
ALDH1A1 P00352 3/20 0.36
KMT2A Q03164 2/20 0.36
HPGD P15428 2/20 0.36
HSD17B10 Q99714 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TP53 P04637 1/20 0.36
TSHR P16473 1/20 0.36
GAA P10253 2/20 0.35
CFTR P13569 1/20 0.35
GLA P06280 1/20 0.35
PKM P14618 1/20 0.35

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
SCHEMBL13998896 0.81 NPSR1 (0.46) NPSR1L3MBTL1KDM4EALDH1A1KMT2A
SCHEMBL1841307 0.79 KDM4E (0.37) KDM4EKMT2A
SCHEMBL27584076 0.79 KDM4E (0.47) NPSR1L3MBTL1KDM4EALDH1A1KMT2A
SCHEMBL8201600 0.78 NPSR1 (0.43) NPSR1L3MBTL1KDM4EALDH1A1KMT2A
SCHEMBL25037121 0.78 NPSR1 (0.43) NPSR1L3MBTL1KDM4EALDH1A1SMN1; SMN2
SCHEMBL17603768 0.77 NPSR1 (0.44) NPSR1L3MBTL1KDM4EALDH1A1HPGD
SCHEMBL1841306 0.77 KDM4E (0.46) NPSR1L3MBTL1KDM4EALDH1A1KMT2A
SCHEMBL16712807 0.74 ALDH1A1 (0.44) KDM4EALDH1A1KMT2AHPGDHSD17B10
SCHEMBL3321442 0.74 CA12 (0.45) NPSR1KDM4EALDH1A1KMT2AHPGD
SCHEMBL21072556 0.73 NOS3 (0.47) NPSR1L3MBTL1KDM4EALDH1A1HPGD

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-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
CN-100352808-C Heterocyclic diamide invertebrate pest control agents DU PONT (US) 2007-12-05 CN 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
CN-1494530-A Heterocyclic diamide invertebrate pest control agents �Ű˾ 2004-05-05 CN 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 NPSR1 158/4885L3MBTL1 279/4885KDM4E 1378/4885
US-20040102324-A1 Heterocyclic diamide invertebrate pest control agents DDT, DBF4, DDC NPSR1 495/4885L3MBTL1 487/4885KDM4E 835/4885

“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.