SCHEMBL4907153

SCHEMBL4907153

COC(=O)c1cc(Br)c(C(F)F)[nH]c1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.44
GLA P06280 1/20 0.44
GAA P10253 1/20 0.44
SOS1 Q07889 1/20 0.40
MAPT P10636 2/20 0.40
ALDH1A1 P00352 2/20 0.36
LMNA P02545 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
NR4A2 P43354 1/20 0.35
XDH P47989 1/20 0.35
CHEK1 O14757 2/20 0.35
CYP1A2 P05177 1/20 0.35
CNR2 P34972 1/20 0.34
NOTUM Q6P988 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
KMT2A Q03164 1/20 0.33
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
MET P08581 1/20 0.33
GSK3B P49841 1/20 0.33

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
SCHEMBL12804666 0.78 ALDH1A1 (0.44) KDM4EGAAALDH1A1CNR2SMN1; SMN2
SCHEMBL3087985 0.78 HPGD (0.42) KDM4EMAPTALDH1A1SMN1; SMN2KMT2A
SCHEMBL16612698 0.78 CUL4A (0.40) KDM4EGAAMAPTALDH1A1SMN1; SMN2
SCHEMBL4668796 0.76 SOS1 (0.49) KDM4EGLAGAASOS1MAPT
SCHEMBL4906582 0.74 SOS1 (0.44) KDM4EGLAGAASOS1MAPT
SCHEMBL12427053 0.71 ALDH1A1 (0.47) KDM4EGLAGAAMAPTALDH1A1
SCHEMBL23051540 0.70 SOS1 (0.50) KDM4EGLAGAASOS1MAPT
SCHEMBL197110 0.70 SOS1 (0.50) KDM4EGLAGAASOS1MAPT
SCHEMBL1857268 0.70 CHEK1 (0.48) KDM4EGLAGAAMAPTALDH1A1
SCHEMBL4898553 0.70 KDM4E (0.60) KDM4EGLAGAAMAPTALDH1A1

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
US-9102623-B2 Pyridinecarboxamides, useful-plant-protecting composition comprising them and processes for their preparation and their use BAYER CROPSCIENCE AG (DE) 2015-08-11 US disclosed
US-20120252670-A1 PYRIDINECARBOXAMIDES, USEFUL-PLANT-PROTECTING COMPOSITION COMPRISING THEM AND PROCESSES FOR THEIR PREPARATION AND THEIR USE ZIEMER FRANK (DE) 2012-10-04 US disclosed
CN-101674727-A Pyridonecarboxamides crop protection agents containing the same method for production and use thereof BAYER CROPSCIENCE AG 2010-03-17 CN disclosed
US-20080269059-A1 PYRIDINECARBOXAMIDES, USEFUL-PLANT-PROTECTING COMPOSITION COMPRISING THEM AND PROCESSES FOR THEIR PREPARTION AND THEIR USE BAYER CROPSCIENCE AG (DE) 2008-10-30 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-20120252670-A1 PYRIDINECARBOXAMIDES, USEFUL-PLANT-PROTECTING COMPOSITION COMPRISING THEM AND PROCESSES FOR THEIR PREPARATION AND THEIR USE CYC1, CYCS, CBR3 KDM4E 740/4885GLA 1905/4885GAA 3433/4885
US-20080269059-A1 PYRIDINECARBOXAMIDES, USEFUL-PLANT-PROTECTING COMPOSITION COMPRISING THEM AND PROCESSES FOR THEIR PREPARTION AND THEIR USE CYC1, PYCR1, CBR3 KDM4E 826/4885GLA 2012/4885GAA 3296/4885

“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.