SCHEMBL4555017

SCHEMBL4555017

COc1ccc(NC(=O)Nc2cc(C)c(OC)cc2OC)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.71
MEN1 O00255 7/20 0.71
KMT2A Q03164 7/20 0.71
TP53 P04637 3/20 0.71
GAA P10253 3/20 0.71
MAPK1 P28482 1/20 0.71
SMN1; SMN2 Q16637 7/20 0.63
RAB9A P51151 7/20 0.63
NPC1 O15118 6/20 0.63
POLB P06746 1/20 0.63
KDM4E B2RXH2 2/20 0.61
HTT P42858 2/20 0.61
ALDH1A1 P00352 2/20 0.58
HPGD P15428 1/20 0.58
LMNA P02545 1/20 0.56
TSHR P16473 1/20 0.55
PKM P14618 1/20 0.55
NFKB1 P19838 1/20 0.55
NFKB2 Q00653 1/20 0.55
RELA Q04206 1/20 0.55

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
SCHEMBL18025321 0.84 MAPT (0.76) MAPTMEN1KMT2ATP53GAA
SCHEMBL19427492 0.84 MEN1 (0.84) MAPTMEN1KMT2ATP53GAA
SCHEMBL21295361 0.81 MEN1 (0.62) MAPTMEN1KMT2ATP53GAA
SCHEMBL30744017 0.81 MEN1 (0.62) MAPTMEN1KMT2ATP53GAA
SCHEMBL4237969 0.80 MAPT (0.67) MAPTMEN1KMT2ATP53GAA
SCHEMBL11092496 0.79 RAB9A (1.00) MAPTMEN1KMT2ATP53SMN1; SMN2
SCHEMBL30222218 0.79 MAPT (0.61) MAPTMEN1KMT2ATP53GAA
SCHEMBL28657313 0.79 MAPT (0.61) MAPTMEN1KMT2ATP53GAA
SCHEMBL13556630 0.78 MAPT (0.61) MAPTMEN1KMT2ATP53GAA
SCHEMBL17079626 0.78 RAB9A (0.73) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120115915-A1 N,N'-DIARYLUREA COMPOUNDS AND N,N'-DIARYLTHIOUREA COMPOUNDS AS INHIBITORS OF TRANSLATION INITIATION PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2012-05-10 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-20120115915-A1 N,N'-DIARYLUREA COMPOUNDS AND N,N'-DIARYLTHIOUREA COMPOUNDS AS INHIBITORS OF TRANSLATION INITIATION NSUN2, EIF2AK2, RNGTT MAPT 1631/4885MEN1 2936/4885KMT2A 761/4885

“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.