SCHEMBL5453447

SCHEMBL5453447

COc1cccc(NC(=O)Nc2ccc(N3CCN(C(=O)OC(C)(C)C)CC3)cc2)c1OC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.56
NPC1 O15118 4/20 0.56
RAB9A P51151 4/20 0.56
NAMPT P43490 1/20 0.56
SMN1; SMN2 Q16637 3/20 0.51
MEN1 O00255 1/20 0.51
TSHR P16473 1/20 0.51
KMT2A Q03164 1/20 0.51
LMNA P02545 4/20 0.50
PABPC1 P11940 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
ALDH1A1 P00352 2/20 0.47
GAA P10253 1/20 0.47
ESR2 Q92731 1/20 0.47
NR2F2 P24468 1/20 0.47
HTT P42858 1/20 0.47
TGFBR1 P36897 1/20 0.46
GFER P55789 1/20 0.46
P2RY1 P47900 1/20 0.46
CCNK O75909 1/20 0.45

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
SCHEMBL5460804 0.91 MAPT (0.68) MAPTNPC1RAB9ANAMPTSMN1; SMN2
SCHEMBL5462675 0.90 NAMPT (0.56) MAPTNPC1RAB9ANAMPTSMN1; SMN2
SCHEMBL5458486 0.87 MAPT (0.61) MAPTNPC1RAB9ANAMPTSMN1; SMN2
SCHEMBL5470937 0.83 MAPT (0.53) MAPTNPC1RAB9ANAMPTSMN1; SMN2
SCHEMBL5466103 0.83 NAMPT (0.59) MAPTNPC1RAB9ANAMPTSMN1; SMN2
SCHEMBL5457972 0.83 NAMPT (0.64) MAPTNPC1RAB9ANAMPTSMN1; SMN2
SCHEMBL5455872 0.82 MAPT (0.56) MAPTNPC1RAB9ANAMPTSMN1; SMN2
SCHEMBL5462055 0.82 NAMPT (0.58) MAPTNPC1RAB9ANAMPTSMN1; SMN2
SCHEMBL5465589 0.82 NAMPT (0.58) MAPTNPC1RAB9ANAMPTSMN1; SMN2
SCHEMBL5455934 0.82 NAMPT (0.58) MAPTNPC1RAB9ANAMPTSMN1; SMN2

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-20070249620-A1 Urea Derivative SANKYO COMPANY, LIMITED (JP) 2007-10-25 US disclosed
EP-1764360-A1 UREA DERIVATIVE Sankyo Company, Limited (JP) 2007-03-21 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-20070249620-A1 Urea Derivative UGP2, SLC14A1, DGAT1 MAPT 758/4885NPC1 1089/4885RAB9A 1528/4885

“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.