SCHEMBL5467247

SCHEMBL5467247

CCO/C(=C\C(=O)C(F)(F)F)C(C)C

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HDAC4 P56524 2/20 0.33
HDAC6 Q9UBN7 2/20 0.33
MAPT P10636 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
LMNA P02545 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ALOX15 P16050 1/20 0.31
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
SOAT1 P35610 1/20 0.31
MMP8 P22894 1/20 0.31
HCAR2 Q8TDS4 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL5467251 1.00 ALDH1A1 (0.33) ALDH1A1NPSR1HDAC4HDAC6MAPT
SCHEMBL3548687 0.79 MAPT (0.35) ALDH1A1MAPT
SCHEMBL3548684 0.79 MAPT (0.35) ALDH1A1MAPT
SCHEMBL1013378 0.76 ALDH1A1 (0.39) ALDH1A1NPSR1HDAC4HDAC6MAPT
SCHEMBL25142327 0.75 HCAR2 (0.38) ALDH1A1NPSR1HDAC4HDAC6MAPT
SCHEMBL28334666 0.75 ALDH1A1 (0.41) ALDH1A1NPSR1HDAC4HDAC6MAPT
SCHEMBL25738552 0.75 ALDH1A1 (0.41) ALDH1A1NPSR1HDAC4HDAC6MAPT
SCHEMBL239789 0.73 ALOX15 (0.43) ALDH1A1NPSR1HDAC4HDAC6MAPT
SCHEMBL239788 0.73 ALOX15 (0.43) ALDH1A1NPSR1HDAC4HDAC6MAPT
SCHEMBL10698807 0.73 MAPT (0.38) ALDH1A1NPSR1HDAC4HDAC6MAPT

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
US-20070275967-A1 Pyrazolinols BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2007-11-29 US disclosed
US-20070275967-A1 Pyrazolinols BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2007-11-29 US disclosed
US-20070275967-A1 Pyrazolinols BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2007-11-29 US disclosed
EP-1697328-A1 PYRAZOLINOLS USED AS PESTICIDES Bayer CropScience Aktiengesellschaft (DE) 2006-09-06 EP disclosed
WO-2005058838-A1 PYRAZOLINOLS USED AS PESTICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2005-06-30 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-20070275967-A1 Pyrazolinols RRS1, RECQL, PNISR ALDH1A1 2701/4885NPSR1 458/4885HDAC4 3257/4885

“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.