SCHEMBL5774643

SCHEMBL5774643

O=C(Nc1ccc(CO)cc1I)C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 5/20 0.41
CA2 P00918 5/20 0.41
PDK1 Q15118 1/20 0.40
PDK2 Q15119 1/20 0.40
PDK3 Q15120 1/20 0.40
PDK4 Q16654 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.36
JAK2 O60674 1/20 0.35
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
KLK7 P49862 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
PTPN5 P54829 1/20 0.35
EPHX2 P34913 1/20 0.35
NR1H4 Q96RI1 1/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL22262290 0.86 HDAC4 (0.42) CA1CA2L3MBTL1CYP1A2CYP2C9
SCHEMBL29659891 0.86 HDAC4 (0.42) CA1CA2L3MBTL1CYP1A2CYP2C9
SCHEMBL23885206 0.82 CYP1A2 (0.43) CA1CA2PDK1PDK2PDK3
SCHEMBL30254618 0.82 CYP1A2 (0.43) CA1CA2PDK1PDK2PDK3
SCHEMBL6988369 0.79 CYP4F2 (0.43) PDK1PDK2PDK3PDK4L3MBTL1
SCHEMBL31115586 0.79 CA1 (0.54) CA1CA2MAPTHTTCYP2C9
SCHEMBL23885419 0.79 CA1 (0.44) CA1CA2L3MBTL1JAK2TP53
SCHEMBL616628 0.79 CA1 (0.54) CA1CA2MAPTHTTCYP2C9
SCHEMBL6824888 0.78 MEN1 (0.51) CA1CA2PTPN5EPHX2MEN1
SCHEMBL1197587 0.78 PDK1 (0.50) CA1CA2PDK1PDK2PDK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060276433-A1 Hydrazone derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-12-07 US disclosed
EP-1612204-A1 HYDRAZONE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-01-04 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-20060276433-A1 Hydrazone derivative APP, PRNP, HTT CA1 763/4885CA2 1416/4885PDK1 3440/4885

“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.