SCHEMBL5469424

SCHEMBL5469424

Fc1cc(F)cc(Cc2c(Cl)ncnc2Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
LMNA P02545 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
IDO1 P14902 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
NTRK1 P04629 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
SCHEMBL856035 0.88 LMNA (0.41) ALDH1A1LMNASMN1; SMN2
SCHEMBL5815622 0.82 ALDH1A1 (0.46) ALDH1A1LMNASMN1; SMN2
SCHEMBL5479186 0.82 ALDH1A1 (0.46) ALDH1A1LMNASMN1; SMN2IDO1
SCHEMBL855865 0.80 ALDH1A1 (0.39) ALDH1A1LMNASMN1; SMN2
SCHEMBL5812511 0.80 LMNA (0.36) ALDH1A1LMNASMN1; SMN2KDM4E
SCHEMBL5822313 0.79 SMN1; SMN2 (0.50) ALDH1A1LMNASMN1; SMN2IDO1KDM4E
SCHEMBL5814625 0.79 MAP4K4 (0.40) ALDH1A1LMNASMN1; SMN2KDM4EMAPT
SCHEMBL5814649 0.76 CA12 (0.36) IDO1NTRK1
SCHEMBL5815110 0.76 ALDH1A1 (0.51) ALDH1A1LMNASMN1; SMN2KDM4E
SCHEMBL31749981 0.73 GPR52 (0.33) IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070167421-A1 Pyrimidine derivatives and use thereof as agricultural and horticultural fungicides ITO MASHITO 2007-07-19 US disclosed
WO-2006136327-A1 FUNGICIDAL BENZYLPYRIMIDINE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2006-12-28 WO disclosed
EP-1718305-A1 PYRIMIDINE DERIVATIVES AND USE THEREOF AS AGRICULTURAL AND HORTICULTURAL FUNGICIDES Bayer CropScience AG (DE) 2006-11-08 EP disclosed
WO-2005079798-A1 PYRIMIDINE DERIVATIVES AND USE THEREOF AS AGRICULTURAL AND HORTICULTURAL FUNGICIDES BAYER CROPSCIENCE AG (DE) 2005-09-01 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-20070167421-A1 Pyrimidine derivatives and use thereof as agricultural and horticultural fungicides DPYD, DHFR, TYMP ALDH1A1 697/4885LMNA 4712/4885SMN1; SMN2 3837/4885

“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.