SCHEMBL5551698

SCHEMBL5551698

NNC(=O)c1cccc(CNC(=O)OCC2c3ccccc3-c3ccccc32)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.49
EPHX2 P34913 1/20 0.49
NPC1 O15118 4/20 0.45
ALDH1A1 P00352 4/20 0.45
RAB9A P51151 4/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
LMNA P02545 2/20 0.45
MEN1 O00255 1/20 0.45
GAA P10253 1/20 0.45
MAPT P10636 1/20 0.45
STAT3 P40763 1/20 0.45
STAT1 P42224 1/20 0.45
PPARG P37231 1/20 0.40
KDM4E B2RXH2 1/20 0.40
TP53 P04637 1/20 0.40
HTT P42858 1/20 0.40
OPRD1 P41143 1/20 0.40
MMP13 P45452 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC8 Q9BY41 1/20 0.40

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
SCHEMBL14452747 0.90 EPHX2 (0.48) KMT2AEPHX2PPARGOPRD1MMP13
SCHEMBL29618948 0.88 KMT2A (0.53) KMT2AEPHX2NPC1RAB9AOPRD1
SCHEMBL119110 0.88 KMT2A (0.53) KMT2AEPHX2NPC1RAB9AOPRD1
SCHEMBL29679265 0.88 KMT2A (0.53) KMT2AEPHX2NPC1RAB9AOPRD1
SCHEMBL3064762 0.86 EPHX2 (0.49) KMT2AEPHX2
SCHEMBL7828581 0.84 KMT2A (0.47) KMT2AEPHX2NPC1RAB9AOPRD1
SCHEMBL1854482 0.84 KMT2A (0.54) KMT2AEPHX2NPC1RAB9ASMN1; SMN2
SCHEMBL18688054 0.83 EPHX2 (0.53) KMT2AEPHX2HTTOPRD1
SCHEMBL19633130 0.83 EPHX2 (0.66) KMT2AEPHX2OPRD1
SCHEMBL3177417 0.83 KMT2A (0.62) KMT2AEPHX2OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070014721-A1 Hydrazide conjugates as imaging agents LANTHEUS MEDICAL IMAGING, INC. 2007-01-18 US disclosed
US-20070014721-A1 Hydrazide conjugates as imaging agents LANTHEUS MEDICAL IMAGING, INC. 2007-01-18 US disclosed
US-20070014721-A1 Hydrazide conjugates as imaging agents LANTHEUS MEDICAL IMAGING, INC. 2007-01-18 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-20070014721-A1 Hydrazide conjugates as imaging agents CA14, CA13, CA1 KMT2A 2223/4885EPHX2 675/4885NPC1 2008/4885

“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.