SCHEMBL1347731

SCHEMBL1347731

COc1ccc(OCc2ccncc2)c(C(=O)NN)c1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 3/20 0.60
ALDH1A1 P00352 6/20 0.50
MAPT P10636 2/20 0.50
HTT P42858 1/20 0.50
NOX1 Q9Y5S8 1/20 0.48
KDM4E B2RXH2 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
TYK2 P29597 1/20 0.46
NPC1 O15118 1/20 0.46
LMNA P02545 1/20 0.46
RAB9A P51151 1/20 0.46
POLB P06746 1/20 0.46
AKR1C3 P42330 2/20 0.46
ABCB1 P08183 1/20 0.46
SGMS2 Q8NHU3 1/20 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
SCHEMBL1345009 0.87 LRRK2 (0.56) LRRK2ALDH1A1MAPTNOX1KDM4E
SCHEMBL1347065 0.82 POLB (0.61) LRRK2ALDH1A1HTTKDM4ESMN1; SMN2
SCHEMBL1348066 0.82 LRRK2 (0.57) LRRK2MAPTHTTKDM4ESMN1; SMN2
SCHEMBL1348069 0.81 LRRK2 (0.67) LRRK2ALDH1A1MAPTHTTKDM4E
SCHEMBL6478100 0.79 CTSD (0.62) ALDH1A1MAPTHTTKDM4ESMN1; SMN2
SCHEMBL1346595 0.79 SGMS2 (0.58) ALDH1A1MAPTHTTKDM4ENPC1
SCHEMBL15742990 0.77 CTSD (0.56) LRRK2ALDH1A1MAPTHTTKDM4E
SCHEMBL29930887 0.77 CTSD (0.56) LRRK2ALDH1A1MAPTHTTKDM4E
SCHEMBL1647152 0.75 LRRK2 (1.00) LRRK2MAPTKDM4ESMN1; SMN2NPC1
SCHEMBL1647498 0.73 FOLH1 (0.63) LRRK2ALDH1A1MAPTHTTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8063034-B2 Oxadiazole derivatives and thiadiazole derivatives having neovascularization inhibitory activity SANTEN PHARMACEUTICAL CO., LTD. (JP) 2011-11-22 US disclosed
US-8063034-B2 Oxadiazole derivatives and thiadiazole derivatives having neovascularization inhibitory activity SANTEN PHARMACEUTICAL CO., LTD. (JP) 2011-11-22 US disclosed
US-8063034-B2 Oxadiazole derivatives and thiadiazole derivatives having neovascularization inhibitory activity SANTEN PHARMACEUTICAL CO., LTD. (JP) 2011-11-22 US disclosed
US-20100016354-A1 NOVEL OXADIAZOLE DERIVATIVES AND THIADIAZOLE DERIVATIVES HAVING NEOVASCULARIZATION INHIBITORY ACTIVITY SANTEN PHARMACEUTICAL CO., LTD. (JP) 2010-01-21 US disclosed
US-20100016354-A1 NOVEL OXADIAZOLE DERIVATIVES AND THIADIAZOLE DERIVATIVES HAVING NEOVASCULARIZATION INHIBITORY ACTIVITY SANTEN PHARMACEUTICAL CO., LTD. (JP) 2010-01-21 US disclosed
US-20100016354-A1 NOVEL OXADIAZOLE DERIVATIVES AND THIADIAZOLE DERIVATIVES HAVING NEOVASCULARIZATION INHIBITORY ACTIVITY SANTEN PHARMACEUTICAL CO., LTD. (JP) 2010-01-21 US disclosed
EP-2128156-A1 NOVEL OXADIAZOLE DERIVATIVES AND THIADIAZOLE DERIVATIVES HAVING NEOVASCULARIZATION INHIBITING ACTIVITY Santen Pharmaceutical Co., Ltd (JP) 2009-12-02 EP 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-20100016354-A1 NOVEL OXADIAZOLE DERIVATIVES AND THIADIAZOLE DERIVATIVES HAVING NEOVASCULARIZATION INHIBITORY ACTIVITY FLT4, VEGFA, FLT1 LRRK2 3361/4885ALDH1A1 232/4885MAPT 4800/4885

“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.