SCHEMBL4284480

SCHEMBL4284480

CC(=O)Nc1nc(CCc2ccc(NC=NN)cc2)cs1

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 19/20 0.67
MAOB P27338 3/20 0.64
KMT2A Q03164 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL6389040 0.90 AOC3 (0.53) AOC3MAOB
SCHEMBL4282825 0.89 AOC3 (0.65) AOC3MAOBKMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL6385485 0.89 AOC3 (0.52) AOC3MAOB
Carbamic Acid SCHEMBL4869434 0.88 AOC3 (0.65) AOC3MAOB
SCHEMBL6390595 0.88 AOC3 (0.66) AOC3MAOB
SCHEMBL4291906 0.87 AOC3 (0.67) AOC3MAOBKMT2ASMN1; SMN2
SCHEMBL4876517 0.85 AOC3 (0.68) AOC3MAOBKMT2ASMN1; SMN2
SCHEMBL5215800 0.85 AOC3 (0.66) AOC3MAOBKMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL6197358 0.83 AOC3 (0.69) AOC3MAOB
SCHEMBL27634179 0.82 AOC3 (0.74) AOC3MAOBKMT2ASMN1; SMN2

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1737450-A1 AQUEOUS COMPOSITION COMPRISING THIAZOLE DERIVATIVE R-Tech Ueno, Ltd. (JP) 2007-01-03 EP claimed
EP-1608365-A1 METHOD FOR TREATING VASCULAR HYPERPERMEABLE DISEASE Sucampo AG (CH) 2005-12-28 EP claimed
WO-2005089755-A1 AQUEOUS COMPOSITION COMPRISING THIAZOLE DERIVATIVE R-TECH UENO, LTD. (JP) 2005-09-29 WO claimed
WO-2004087138-A1 METHOD FOR TREATING VASCULAR HYPERPERMEABLE DISEASE SUCAMPO AG (CH) 2004-10-14 WO claimed
US-20140170160-A1 METHODS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH ANGIOGENESIS USING A VASCULAR ADHESION PROTEIN-1 (VAP-1) INHIBITOR MASSACHUSETTS EYE & EAR INFIRMARY (US) 2014-06-19 US disclosed
US-20090170770-A1 METHODS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH ANGIOGENESIS USING A VASCULAR ADHESION PROTEIN-1 (VAP 1) INHIBITOR NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2009-07-02 US disclosed
EP-1608365-A1 METHOD FOR TREATING VASCULAR HYPERPERMEABLE DISEASE Sucampo AG (CH) 2005-12-28 EP disclosed
WO-2004087138-A1 METHOD FOR TREATING VASCULAR HYPERPERMEABLE DISEASE SUCAMPO AG (CH) 2004-10-14 WO 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 (2 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-20140170160-A1 METHODS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH ANGIOGENESIS USING A VASCULAR ADHESION PROTEIN-1 (VAP-1) INHIBITOR VCAM1, VAPB, VAPA AOC3 348/4885MAOB 1629/4885KMT2A 3645/4885
US-20090170770-A1 METHODS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH ANGIOGENESIS USING A VASCULAR ADHESION PROTEIN-1 (VAP 1) INHIBITOR VCAM1, VAPB, FLT1 AOC3 402/4885MAOB 1593/4885KMT2A 3327/4885

“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.