SCHEMBL3792309

SCHEMBL3792309

CCC1(Cc2ccc(F)cc2)NC(=O)C(Cc2c(F)cccc2[N+](=O)[O-])N(C)C1=O

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.34
ALDH1A1 P00352 6/20 0.32
MMP1 P03956 1/20 0.32
MMP9 P14780 1/20 0.32
KDM4E B2RXH2 1/20 0.32
KMT2A Q03164 1/20 0.32
HTT P42858 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL3792854 0.94 TDP1 (0.34) LMNAALDH1A1MMP1MMP9KMT2A
SCHEMBL3798367 0.93 ALDH1A1 (0.34) LMNAALDH1A1MMP1MMP9KDM4E
SCHEMBL3795274 0.90 ALDH1A1 (0.34) LMNAALDH1A1MMP1MMP9KDM4E
SCHEMBL3804544 0.89 HTR6 (0.32) LMNAMMP1MMP9
SCHEMBL3797570 0.89 ALDH1A1 (0.32) LMNAALDH1A1MMP1MMP9KDM4E
SCHEMBL3799436 0.87 ALDH1A1 (0.40) LMNAALDH1A1KDM4EKMT2AHTT
SCHEMBL3022044 0.87 LMNA (0.35) LMNAALDH1A1MMP1MMP9KDM4E
SCHEMBL3800986 0.84 TDP1 (0.35) LMNAALDH1A1MMP1MMP9KMT2A
SCHEMBL3798222 0.84 GFER (0.32) LMNAALDH1A1KMT2A
SCHEMBL3796441 0.83 HTR1A (0.36) LMNAALDH1A1KDM4EKMT2AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100173777-A1 Piperazine Compounds Having Herbicidal Action BASF SE (DE) 2010-07-08 US claimed
EP-2054394-B1 PIPERAZINE COMPOUNDS WITH A HERBICIDAL ACTION BASF SE (DE) 2009-11-18 EP claimed
EP-2054394-A2 PIPERAZINE COMPOUNDS WITH A HERBICIDAL ACTION Basf Se (DE) 2009-05-06 EP claimed
WO-2008152072-A2 PIPERAZINE COMPOUNDS WITH A HERBICIDAL ACTION BASF SE (DE) 2008-12-18 WO claimed
US-20100173777-A1 Piperazine Compounds Having Herbicidal Action BASF SE (DE) 2010-07-08 US disclosed
EP-2054394-B1 PIPERAZINE COMPOUNDS WITH A HERBICIDAL ACTION BASF SE (DE) 2009-11-18 EP disclosed
EP-2054394-A2 PIPERAZINE COMPOUNDS WITH A HERBICIDAL ACTION Basf Se (DE) 2009-05-06 EP disclosed
WO-2008152072-A2 PIPERAZINE COMPOUNDS WITH A HERBICIDAL ACTION 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-20100173777-A1 Piperazine Compounds Having Herbicidal Action CBR3, CBR1, CNPY2 LMNA 1108/4885ALDH1A1 1174/4885MMP1 1030/4885

“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.