SCHEMBL3796902

SCHEMBL3796902

CCC1(Cc2ccc(F)cc2)C(=O)N(C)C(Cc2c(F)cccc2C#N)C(=O)N1C

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 2/20 0.32
RORC P51449 3/20 0.31
NR1I2 O75469 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
AR P10275 1/20 0.30

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
SCHEMBL4254811 0.95 RORC (0.31) RORCNR1I2
SCHEMBL3797044 0.93 ELANE (0.31)
SCHEMBL3797039 0.92 KCNA5 (0.31) KCNA5MEN1KMT2AAR
SCHEMBL3797565 0.91 KDM4E (0.32) KCNA5AR
SCHEMBL3791957 0.89 AR (0.32) MEN1KMT2AAR
SCHEMBL3792315 0.88
SCHEMBL3017368 0.87 AR (0.33) KCNA5AR
SCHEMBL3799444 0.87 TACR1 (0.35) KCNA5RORCNR1I2AR
SCHEMBL3793891 0.83 LMNA (0.37) MEN1KMT2A
SCHEMBL3795636 0.83 ACHE (0.35) MEN1KMT2AAR

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 11 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
CN-101702907-A Piperazine compounds with a herbicidal action BASF SE 2010-05-05 CN claimed
CN-101679316-A Piperazine compounds with a herbicidal action BASF SE 2010-03-24 CN 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
CN-101702907-A Piperazine compounds with a herbicidal action BASF SE 2010-05-05 CN disclosed
CN-101679316-A Piperazine compounds with a herbicidal action BASF SE 2010-03-24 CN disclosed
CN-101677540-A Herbicidally effective composition EIKE HUPE 2010-03-24 CN disclosed
EP-2054394-B1 PIPERAZINE COMPOUNDS WITH A HERBICIDAL ACTION BASF SE (DE) 2009-11-18 EP 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 KCNA5 330/4885RORC 2821/4885NR1I2 585/4885

“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.