SCHEMBL458978

SCHEMBL458978

O=C(O)c1ccnc2oncc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.44
KDM4A O75164 5/20 0.44
L3MBTL1 Q9Y468 4/20 0.44
EGLN1 Q9GZT9 2/20 0.44
RAB9A P51151 1/20 0.44
HIF1AN Q9NWT6 1/20 0.44
PSMD14 O00487 1/20 0.41
ASPH Q12797 2/20 0.41
KDM8 Q8N371 2/20 0.41
LMNA P02545 2/20 0.40
KDM4C Q9H3R0 7/20 0.38
KDM6B O15054 3/20 0.38
KDM4D Q6B0I6 3/20 0.38
TDP1 Q9NUW8 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
MEN1 O00255 1/20 0.38
THRB P10828 1/20 0.38
KMT2A Q03164 1/20 0.38
KDM5C P41229 2/20 0.37

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
SCHEMBL18320640 0.84 KDM4E (0.45) KDM4EL3MBTL1TDP1ALDH1A1KMT2A
SCHEMBL8905252 0.74 KDM4E (0.46) KDM4EKDM4AL3MBTL1EGLN1RAB9A
SCHEMBL29556611 0.69 NR4A1 (0.46) KDM4EKDM4AL3MBTL1EGLN1RAB9A
SCHEMBL1088793 0.69 KDM4E (0.67) KDM4EKDM4AL3MBTL1EGLN1RAB9A
SCHEMBL8413518 0.66 KDM4C (0.52) KDM4EKDM4AL3MBTL1EGLN1RAB9A
SCHEMBL8415023 0.66 KDM4C (0.52) KDM4EKDM4AL3MBTL1EGLN1RAB9A
SCHEMBL28512682 0.65 KDM4E (0.57) KDM4EKDM4AL3MBTL1EGLN1RAB9A
SCHEMBL29705507 0.64 KDM4E (0.44) KDM4EKDM4AL3MBTL1EGLN1RAB9A
SCHEMBL1694708 0.64 KDM4E (0.44) KDM4EKDM4AL3MBTL1EGLN1RAB9A
SCHEMBL28939505 0.64 KDM4E (0.44) KDM4EKDM4AL3MBTL1EGLN1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9609870-B2 Herbicidal isoxazolo[5,4-b]pyridines BASF SE (DE) 2017-04-04 US claimed
US-20160037776-A1 Herbicidal Isoxazolo[5,4-B]pyridines BASF SE (DE) 2016-02-11 US claimed
EP-2595995-B1 HERBICIDAL ISOXAZOLO[5,4-B]PYRIDINES BASF SE (DE) 2015-11-25 EP claimed
EP-2595995-A1 HERBICIDAL ISOXAZOLO[5,4-B]PYRIDINES BASF SE (DE) 2013-05-29 EP claimed
US-20130123105-A1 Herbicidal Isoxazolo[5,4-B]pyridines BASF SE (DE) 2013-05-16 US claimed
WO-2012010633-A1 HERBICIDAL ISOXAZOLO[5,4-B]PYRIDINES BASF SE (DE) 2012-01-26 WO claimed
US-10334851-B2 Herbicidal isoxazolo[5,4-B]pyridines BASF SE (DE) 2019-07-02 US disclosed
US-20170367340-A1 Herbicidal Isoxazolo[5,4-B]pyridines BASF SE (DE) 2017-12-28 US disclosed
US-9609870-B2 Herbicidal isoxazolo[5,4-b]pyridines BASF SE (DE) 2017-04-04 US disclosed
US-20160037777-A1 Herbicidal Isoxazolo[5,4-B]pyridines BASF SE (DE) 2016-02-11 US disclosed
US-20160037776-A1 Herbicidal Isoxazolo[5,4-B]pyridines BASF SE (DE) 2016-02-11 US disclosed
EP-2595995-B1 HERBICIDAL ISOXAZOLO[5,4-B]PYRIDINES BASF SE (DE) 2015-11-25 EP disclosed
US-9131695-B2 Herbicidal isoxazolo[5,4-B]pyridines BASF SE (DE) 2015-09-15 US disclosed
EP-2595995-A1 HERBICIDAL ISOXAZOLO[5,4-B]PYRIDINES BASF SE (DE) 2013-05-29 EP disclosed
US-20130123105-A1 Herbicidal Isoxazolo[5,4-B]pyridines BASF SE (DE) 2013-05-16 US disclosed
WO-2012010633-A1 HERBICIDAL ISOXAZOLO[5,4-B]PYRIDINES BASF SE (DE) 2012-01-26 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 (5 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-10334851-B2 Herbicidal isoxazolo[5,4-B]pyridines CYP4X1, PNPO, PRDX4 KDM4E 972/4885KDM4A 807/4885L3MBTL1 3147/4885
US-20130123105-A1 Herbicidal Isoxazolo[5,4-B]pyridines CYP4X1, PNPO, PRDX4 KDM4E 972/4885KDM4A 807/4885L3MBTL1 3147/4885
US-20160037777-A1 Herbicidal Isoxazolo[5,4-B]pyridines CYP4X1, PNPO, PRDX4 KDM4E 972/4885KDM4A 807/4885L3MBTL1 3147/4885
US-20160037776-A1 Herbicidal Isoxazolo[5,4-B]pyridines CYP4X1, PNPO, PRDX4 KDM4E 972/4885KDM4A 807/4885L3MBTL1 3147/4885
US-20170367340-A1 Herbicidal Isoxazolo[5,4-B]pyridines CYP4X1, PNPO, PRDX4 KDM4E 972/4885KDM4A 807/4885L3MBTL1 3147/4885

“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.