SCHEMBL5453537

SCHEMBL5453537

COc1ccc(C)cc1NC(=O)Nc1ccc(N2CCNCC2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.63
MEN1 O00255 5/20 0.63
KMT2A Q03164 5/20 0.63
TP53 P04637 2/20 0.63
GAA P10253 2/20 0.63
MAPK1 P28482 1/20 0.63
ALDH1A1 P00352 3/20 0.61
RAB9A P51151 4/20 0.57
LMNA P02545 2/20 0.57
HTT P42858 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
CASP3 P42574 2/20 0.57
SENP7 Q9BQF6 2/20 0.57
SENP6 Q9GZR1 1/20 0.57
NPC1 O15118 2/20 0.56
CA12 O43570 2/20 0.55
CA1 P00915 2/20 0.55
CA2 P00918 2/20 0.55
CA9 Q16790 2/20 0.55
NPSR1 Q6W5P4 2/20 0.53

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
SCHEMBL5473719 0.96 MAPT (0.58) MAPTMEN1KMT2ATP53GAA
SCHEMBL5465517 0.91 MAPT (0.56) MAPTMEN1KMT2ATP53GAA
SCHEMBL5458428 0.88 MAPT (0.57) MAPTMEN1KMT2ATP53GAA
SCHEMBL5465065 0.88 MEN1 (0.58) MAPTMEN1KMT2AGAAALDH1A1
SCHEMBL5462052 0.88 MAPT (0.58) MAPTMEN1KMT2ATP53GAA
SCHEMBL5473503 0.86 MAPT (0.57) MAPTMEN1KMT2ATP53GAA
SCHEMBL5463389 0.86 MAPT (0.53) MAPTMEN1KMT2ATP53GAA
SCHEMBL5469455 0.86 MAPT (0.57) MAPTMEN1KMT2ATP53GAA
SCHEMBL5462104 0.86 MAPT (0.63) MAPTMEN1KMT2ATP53GAA
SCHEMBL5460083 0.85 RAB9A (0.77) MAPTMEN1KMT2ATP53GAA

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 758/4885MEN1 1828/4885KMT2A 1350/4885

“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.