SCHEMBL7549067

SCHEMBL7549067

COCCOC(Cc1cnc2ccc(OCc3ccc([N+](=O)[O-])cc3)cc2c1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.47
ITGB3 P05106 1/20 0.46
ITGA2B P08514 1/20 0.46
MAPT P10636 4/20 0.45
MAPK1 P28482 3/20 0.45
LMNA P02545 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
NPSR1 Q6W5P4 2/20 0.45
XBP1 P17861 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
PPARA Q07869 2/20 0.43
MAOA P21397 1/20 0.42
PLA2G4B P0C869 1/20 0.40
PPARG P37231 1/20 0.39
PPARD Q03181 1/20 0.39
MMP1 P03956 1/20 0.39
PTPN1 P18031 1/20 0.39
ABCG2 Q9UNQ0 1/20 0.39

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
SCHEMBL7548625 0.90 PPARA (0.55) MAOBITGB3ITGA2BMAPTMAPK1
SCHEMBL7551266 0.82 MAOB (0.58) MAOBITGB3ITGA2BMAPTMAPK1
SCHEMBL7556358 0.80 PTPN1 (0.47) MAOBPPARAMAOAPPARGPPARD
SCHEMBL7550100 0.77 PPARA (0.60) MAOBPPARAMAOAPPARGPPARD
SCHEMBL7069695 0.70 PPARA (0.55) MAOBPPARAPPARGPPARD
SCHEMBL27994380 0.70 ALDH1A1 (0.57) MAOBMAPTMAPK1LMNASMN1; SMN2
SCHEMBL7551490 0.69 PPARA (0.60) MAOBPPARAMAOAPPARGPPARD
SCHEMBL20377564 0.68 MAOB (0.76) MAOBITGB3ITGA2BMAPTMAPK1
SCHEMBL7070013 0.68 PPARA (0.67) PPARAPPARGPPARD
SCHEMBL7067696 0.67 PPARA (0.51) PPARAPPARGPPARD

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-20020032330-A1 Propionic acid derivatives NOMURA YUTAKA (JP) 2002-03-14 US disclosed
EP-0994095-A1 PROPIONIC ACID DERIVATIVES NIPPON CHEMIPHAR CO., LTD. (JP) 2000-04-19 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-20020032330-A1 Propionic acid derivatives ABAT, ACAT1, PDXK MAOB 1256/4885ITGB3 2584/4885ITGA2B 2729/4885

“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.