SCHEMBL5447957

SCHEMBL5447957

COc1ccc(OCc2nnc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)s2)cc1OC

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.56
L3MBTL1 Q9Y468 1/20 0.54
HPN P05981 1/20 0.54
PTPRE P23469 2/20 0.53
BLM P54132 1/20 0.53
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CA7 P43166 1/20 0.53
CA9 Q16790 1/20 0.53
BRAF P15056 4/20 0.52
RAF1 P04049 3/20 0.52
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
KDR P35968 3/20 0.49
HTR2A P28223 1/20 0.47
HTR2C P28335 1/20 0.47

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
SCHEMBL5450981 0.90 MAPT (0.59) MAPTL3MBTL1HPNPTPREBLM
SCHEMBL5438309 0.86 KMT2A (0.70) L3MBTL1BLMCA1CA2CA7
SCHEMBL5446284 0.85 MEN1 (0.59) MAPTL3MBTL1BLMCA1CA2
SCHEMBL5442863 0.85 MAPT (0.58) MAPTL3MBTL1HPNPTPRERAF1
SCHEMBL5442574 0.84 MAPT (0.58) MAPTL3MBTL1HPNPTPREBRAF
SCHEMBL5444273 0.83 HPN (0.76) MAPTL3MBTL1HPNPTPREMEN1
SCHEMBL5435664 0.82 MAPT (0.59) MAPTL3MBTL1HPNPTPREMEN1
SCHEMBL5449666 0.81 MAPT (0.59) MAPTL3MBTL1HPNPTPREMEN1
SCHEMBL5447931 0.81 BLM (0.57) MAPTL3MBTL1BLMCA1CA2
SCHEMBL5443077 0.80 HPN (0.64) MAPTL3MBTL1HPNPTPREMEN1

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 3983/4885L3MBTL1 1823/4885HPN 4058/4885

“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.