SCHEMBL5449666

SCHEMBL5449666

COc1ccc(OCc2nnc(NC(=O)Nc3cccc(C(F)(F)F)c3F)s2)cc1OC

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.59
MEN1 O00255 6/20 0.54
KMT2A Q03164 6/20 0.54
HTT P42858 1/20 0.54
ATM Q13315 1/20 0.54
PTPRE P23469 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
HPN P05981 1/20 0.47
NPC1 O15118 1/20 0.46
ALDH1A1 P00352 1/20 0.46
RAB9A P51151 1/20 0.46

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
SCHEMBL5454319 0.85 MEN1 (0.62) MEN1KMT2ASMN1; SMN2L3MBTL1NPC1
SCHEMBL5439608 0.85 MEN1 (0.48) MAPTMEN1KMT2ASMN1; SMN2L3MBTL1
SCHEMBL5450981 0.83 MAPT (0.59) MAPTMEN1KMT2AHTTATM
SCHEMBL5444496 0.83 MAPT (0.60) MAPTMEN1KMT2AHTTATM
SCHEMBL5442574 0.82 MAPT (0.58) MAPTMEN1KMT2AHTTPTPRE
SCHEMBL5436770 0.82 KMT2A (0.50) MAPTMEN1KMT2ASMN1; SMN2L3MBTL1
SCHEMBL5442863 0.81 MAPT (0.58) MAPTMEN1KMT2AHTTATM
SCHEMBL5447957 0.81 MAPT (0.56) MAPTMEN1KMT2APTPREL3MBTL1
SCHEMBL5447930 0.81 MEN1 (0.56) MEN1KMT2ASMN1; SMN2L3MBTL1NPC1
SCHEMBL5435664 0.80 MAPT (0.59) MAPTMEN1KMT2AHTTATM

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-20070191353-A1 Use of thiadiazoleurea derivatives MERCK PATENT GMBH (DE) 2007-08-16 US claimed
US-20070191353-A1 Use of thiadiazoleurea derivatives MERCK PATENT GMBH (DE) 2007-08-16 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-20070191353-A1 Use of thiadiazoleurea derivatives RAF1, ARAF, JAK1 MAPT 3983/4885MEN1 1756/4885KMT2A 1865/4885

“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.