SCHEMBL6745488

SCHEMBL6745488

COC(=O)C(Cl)Cc1cc(-c2ncc(C(F)(F)F)c(C)c2Cl)c(F)cc1Cl

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.36
HPGD P15428 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
KCNQ3 O43525 2/20 0.31
KCNQ2 O43526 2/20 0.31
KCNE1 P15382 2/20 0.31
KCNQ1 P51787 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ALDH1A1 P00352 1/20 0.31
RORC P51449 1/20 0.31
SCN9A Q15858 3/20 0.30
SCN5A Q14524 1/20 0.30
GAA P10253 2/20 0.30
KDM4E B2RXH2 1/20 0.30
HTR2A P28223 1/20 0.30
MAPT P10636 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL6740866 0.78 MAPK1 (0.35) MAPK1HPGDSCN9AGAAMAPT
SCHEMBL6742688 0.76 SCN9A (0.33) HPGDALDH1A1SCN9ASCN5AGAA
SCHEMBL6722887 0.76 KMT2A (0.34) MAPK1HPGDL3MBTL1ALDH1A1KDM4E
SCHEMBL6742533 0.75 ASPH (0.41) RORCSCN9A
SCHEMBL6739675 0.74 LRRK2 (0.36)
SCHEMBL6742514 0.74 COMT (0.34) RORC
SCHEMBL6743960 0.72 KDM4E (0.33) ALDH1A1KDM4E
SCHEMBL6716083 0.71 CYP3A4 (0.35) MEN1KMT2A
SCHEMBL6740532 0.69 PGK1 (0.37) KMT2A
SCHEMBL6744382 0.69 MAPT (0.38) HPGDALDH1A1GAAKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040043903-A1 Herbicides; applying to plants BASF AKTIENGESELLSCHAFT (DE) 2004-03-04 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-20040043903-A1 Herbicides; applying to plants DDT, DRD1, DRD4 MAPK1 1708/4885HPGD 2494/4885NPSR1 2488/4885

“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.