SCHEMBL3023680

SCHEMBL3023680

CN1C(=O)C(Cc2ccccc2)N(C)C(=O)C1=Cc1c(F)cccc1[N+](=O)[O-]

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 2/20 0.38
XDH P47989 1/20 0.36
GFER P55789 1/20 0.35
ALDH1A1 P00352 3/20 0.34
KMT2A Q03164 4/20 0.33
POLB P06746 3/20 0.33
MEN1 O00255 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
LMNA P02545 1/20 0.33
NOD2 Q9HC29 1/20 0.32
HTT P42858 1/20 0.32
ACHE P22303 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HDAC6 Q9UBN7 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
SCHEMBL3023678 1.00 MMP2 (0.38) MMP2XDHGFERALDH1A1KMT2A
SCHEMBL3015641 0.93 LMNA (0.36) MMP2XDHALDH1A1KMT2AMEN1
SCHEMBL3015643 0.93 LMNA (0.36) MMP2XDHALDH1A1KMT2AMEN1
SCHEMBL3027837 0.89 MMP2 (0.38) MMP2XDHGFERALDH1A1KMT2A
SCHEMBL3027834 0.89 MMP2 (0.38) MMP2XDHGFERALDH1A1KMT2A
SCHEMBL3022198 0.86 ALDH1A1 (0.39) MMP2XDHGFERALDH1A1KMT2A
SCHEMBL3022201 0.86 ALDH1A1 (0.39) MMP2XDHGFERALDH1A1KMT2A
SCHEMBL3017186 0.86 XDH (0.42) MMP2XDHGFERALDH1A1KMT2A
SCHEMBL3017189 0.86 XDH (0.42) MMP2XDHGFERALDH1A1KMT2A
SCHEMBL3017366 0.84 XDH (0.35) MMP2XDHALDH1A1KMT2AMEN1

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
US-20100190794-A1 Herbicidally Active Composition BASF SE (DE) 2010-07-29 US claimed
EP-2157856-A1 HERBICIDALLY EFFECTIVE COMPOSITION Basf Se (DE) 2010-03-03 EP claimed
WO-2008152074-A1 HERBICIDALLY EFFECTIVE COMPOSITION BASF SE (DE) 2008-12-18 WO claimed
US-20100190794-A1 Herbicidally Active Composition BASF SE (DE) 2010-07-29 US disclosed
EP-2157856-A1 HERBICIDALLY EFFECTIVE COMPOSITION Basf Se (DE) 2010-03-03 EP disclosed
WO-2008152074-A1 HERBICIDALLY EFFECTIVE COMPOSITION BASF SE (DE) 2008-12-18 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 (1 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-20100190794-A1 Herbicidally Active Composition ECI1, ACLY, SQOR MMP2 1650/4885XDH 1655/4885GFER 47/4885

“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.