SCHEMBL5439554

SCHEMBL5439554

COc1ccc(Oc2nnc(NC(=O)Nc3ccc(F)c(C(F)(F)F)c3)s2)cc1OC

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.55
WRN Q14191 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.48
KDR P35968 5/20 0.48
CDK8 P49336 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
HSD17B10 Q99714 1/20 0.47
BRAF P15056 6/20 0.46
MAPT P10636 5/20 0.46
MAPK1 P28482 1/20 0.46
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
TSHR P16473 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
RAF1 P04049 2/20 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
SCHEMBL5450981 0.85 MAPT (0.59) BLMWRNL3MBTL1MEN1KMT2A
SCHEMBL5444618 0.84 RAF1 (0.54) KDRCDK8MEN1KMT2ABRAF
SCHEMBL5454402 0.84 BLM (0.71) BLMWRNKDRCDK8BRAF
SCHEMBL5439608 0.83 MEN1 (0.48) L3MBTL1KDRMEN1KMT2AMAPT
SCHEMBL5441696 0.81 BLM (0.55) BLMWRNL3MBTL1KDRMEN1
SCHEMBL5435490 0.81 LMNA (0.58) L3MBTL1KDRCDK8MEN1KMT2A
SCHEMBL5446510 0.81 KMT2A (0.75) BLMWRNL3MBTL1MEN1KMT2A
SCHEMBL5439656 0.80 MEN1 (0.62) BLMWRNL3MBTL1MEN1KMT2A
SCHEMBL5447957 0.75 MAPT (0.56) BLML3MBTL1KDRMEN1KMT2A
SCHEMBL16621285 0.73 RAF1 (0.69) KDRCDK8MEN1KMT2ABRAF

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 BLM 4089/4885WRN 3961/4885L3MBTL1 1823/4885

“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.