SCHEMBL13558405

SCHEMBL13558405

CCc1cc(C(F)(C(F)(F)F)C(F)(F)F)cc(C)c1N(C)C(=O)c1ccc2cc(Br)ccc2c1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
DHODH Q02127 1/20 0.34
NCEH1 Q6PIU2 3/20 0.34
HPGD P15428 1/20 0.34
PLAU P00749 2/20 0.33
PTPN1 P18031 1/20 0.32
GPBAR1 Q8TDU6 2/20 0.32
NR1H3 Q13133 1/20 0.32
NOTUM Q6P988 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 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
SCHEMBL12950974 0.87 LMNA (0.35) LMNAPLAUGPBAR1NR1H3
SCHEMBL998644 0.80 DHODH (0.46) DHODHHPGDPLAUMEN1KMT2A
SCHEMBL12950948 0.77 DHODH (0.36) LMNADHODHHPGDPLAUKMT2A
SCHEMBL29409942 0.69 NR1H3 (0.54) LMNAGPBAR1NR1H3KMT2A
SCHEMBL15429580 0.69 HPGD (0.47) HPGDGPBAR1NR1H3MEN1KMT2A
SCHEMBL12951216 0.67 MAPT (0.38) DHODHHPGDPLAUMEN1KMT2A
SCHEMBL1844491 0.67 PTGS1 (0.44) LMNAGPBAR1NR1H3MEN1KMT2A
SCHEMBL18726192 0.66 DHODH (0.50) LMNADHODHPLAU
SCHEMBL12659386 0.65 GPBAR1 (0.40) GPBAR1NR1H3
SCHEMBL19240535 0.65 GPBAR1 (0.38) LMNAGPBAR1NR1H3MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2456759-B1 PESTICIDAL CARBOXAMIDES BAYER CROPSCIENCE AG (DE) 2017-04-19 EP disclosed
US-8822691-B2 Pesticidal carboxamides BAYER CROPSCIENCE AG (DE) 2014-09-02 US disclosed
US-8822691-B2 Pesticidal carboxamides BAYER CROPSCIENCE AG (DE) 2014-09-02 US disclosed
US-20120277185-A1 Pesticidal Carboxamides BAYER CROPSCIENDE AG (DE) 2012-11-01 US disclosed
US-20120277185-A1 Pesticidal Carboxamides BAYER CROPSCIENDE AG (DE) 2012-11-01 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 (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-20120277185-A1 Pesticidal Carboxamides DDT, ACHE, AADAC LMNA 3905/4885L3MBTL1 535/4885DHODH 750/4885

“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.