SCHEMBL2363781

SCHEMBL2363781

CCCCC/C=C(/C(=O)OCC)[N+](=O)[O-]

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.50
PPARG P37231 9/20 0.47
PPARA Q07869 3/20 0.47
TRPA1 O75762 1/20 0.47
FBP1 P09467 1/20 0.47
CYP1A2 P05177 1/20 0.46
CYP2C19 P33261 1/20 0.46
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
HPGD P15428 1/20 0.40
EP300 Q09472 1/20 0.40
FABP3 P05413 3/20 0.34
MGLL Q99685 1/20 0.34

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
SCHEMBL1566733 1.00 FAAH (0.50) FAAHPPARGPPARATRPA1FBP1
SCHEMBL23941092 0.81 CYP1A2 (0.51) FAAHCYP1A2CYP2C19ALDH1A1LMNA
SCHEMBL6369893 0.78 PPARG (0.58) FAAHPPARGPPARATRPA1FBP1
SCHEMBL21925331 0.78 PPARG (0.58) FAAHPPARGPPARATRPA1FBP1
SCHEMBL21925330 0.78 PPARG (0.58) FAAHPPARGPPARATRPA1FBP1
SCHEMBL6369891 0.78 PPARG (0.58) FAAHPPARGPPARATRPA1FBP1
SCHEMBL16110273 0.77 CYP1A2 (0.52) FAAHCYP1A2CYP2C19ALDH1A1LMNA
SCHEMBL17674143 0.77 CYP1A2 (0.54) FAAHCYP1A2CYP2C19ALDH1A1LMNA
SCHEMBL17674145 0.77 CYP1A2 (0.54) FAAHCYP1A2CYP2C19ALDH1A1LMNA
SCHEMBL14706091 0.77 CYP1A2 (0.54) FAAHCYP1A2CYP2C19ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9012038-B2 Phosphorescent metal complex compound, method for the preparation thereof and radiating component OSRAM GMBH (DE) 2015-04-21 US disclosed
EP-2307430-B1 PHOSPHORESCENT METAL COMPLEX COMPOUND, METHOD FOR THE PREPARATION THEREOF AND RADIATING COMPONENT OSRAM GMBH (DE) 2014-08-27 EP disclosed
US-20110187265-A1 PHOSPHORESCENT METAL COMPLEX COMPOUND, METHOD FOR THE PREPARATION THEREOF AND RADIATING COMPONENT OSRAM OLED GMBH (DE) 2011-08-04 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-20110187265-A1 PHOSPHORESCENT METAL COMPLEX COMPOUND, METHOD FOR THE PREPARATION THEREOF AND RADIATING COMPONENT OSTC, ORC3, OSBP FAAH 4878/4885PPARG 1911/4885PPARA 1528/4885

“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.