SCHEMBL5439608

SCHEMBL5439608

COc1ccc(Oc2nnc(NC(=O)Nc3cccc(C(F)(F)F)c3F)s2)cc1OC

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.48
KMT2A Q03164 5/20 0.48
PDGFRA P16234 1/20 0.42
KDR P35968 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
MAPT P10636 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
LPAR1 Q92633 1/20 0.41
POLB P06746 1/20 0.40
PKM P14618 1/20 0.40

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
SCHEMBL5449666 0.85 MAPT (0.59) MEN1KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL5436770 0.84 KMT2A (0.50) MEN1KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL5444864 0.83 KDM4E (0.47) KMT2AKDRSMN1; SMN2NPC1RAB9A
SCHEMBL5439554 0.83 BLM (0.55) MEN1KMT2AKDRSMN1; SMN2NPC1
SCHEMBL5444881 0.82 MEN1 (0.48) MEN1KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL5444618 0.81 RAF1 (0.54) MEN1KMT2AKDRSMN1; SMN2NPC1
SCHEMBL5447930 0.81 MEN1 (0.56) MEN1KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL5454319 0.80 MEN1 (0.62) MEN1KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL5435490 0.76 LMNA (0.58) MEN1KMT2APDGFRAKDRSMN1; SMN2
SCHEMBL6378070 0.69 MAPT (0.61) MEN1KMT2ASMN1; SMN2NPC1RAB9A

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 MEN1 1756/4885KMT2A 1865/4885PDGFRA 673/4885

“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.