SCHEMBL3024360

SCHEMBL3024360

COc1cccc([N+](=O)[O-])c1/C=C1\C(=O)N(C)C(Cc2ccc(F)cc2)C(=O)N1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
LMNA P02545 3/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
MAPT P10636 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
MCL1 Q07820 1/20 0.38
TXNRD1 Q16881 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
GAA P10253 1/20 0.34
XDH P47989 1/20 0.34
SNCA P37840 1/20 0.34
TDP2 O95551 1/20 0.34
KDM4E B2RXH2 1/20 0.33
PLIN1 O60240 1/20 0.33
PABPC1 P11940 1/20 0.33
PLIN5 Q00G26 1/20 0.33
ABHD5 Q8WTS1 1/20 0.33
MMP1 P03956 1/20 0.33
MMP9 P14780 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
SCHEMBL3024361 1.00 ALDH1A1 (0.38) ALDH1A1LMNAKMT2AMEN1MAPT
SCHEMBL3022198 0.93 ALDH1A1 (0.39) ALDH1A1LMNAKMT2AMEN1MAPT
SCHEMBL3022201 0.93 ALDH1A1 (0.39) ALDH1A1LMNAKMT2AMEN1MAPT
SCHEMBL3015641 0.90 LMNA (0.36) ALDH1A1LMNAKMT2AMEN1MAPT
SCHEMBL3015643 0.90 LMNA (0.36) ALDH1A1LMNAKMT2AMEN1MAPT
SCHEMBL3017364 0.89 XDH (0.35) ALDH1A1LMNAKMT2AMEN1MAPT
SCHEMBL3017366 0.89 XDH (0.35) ALDH1A1LMNAKMT2AMEN1MAPT
SCHEMBL3022040 0.84 TXNRD1 (0.35) ALDH1A1LMNAKMT2AMEN1MAPT
SCHEMBL3022041 0.84 TXNRD1 (0.35) ALDH1A1LMNAKMT2AMEN1MAPT
SCHEMBL3026212 0.84 XDH (0.49) ALDH1A1LMNAKMT2AMEN1MAPT

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 ALDH1A1 1128/4885LMNA 3263/4885KMT2A 2213/4885

“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.