SCHEMBL970532

SCHEMBL970532

CCCCCCOc1cc(C(=O)NNC(=O)c2ccc(C(=O)OC)cc2)cc(OCCCCCC)c1OCCCCCC

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 6/20 0.54
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
CNR2 P34972 2/20 0.46

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
SCHEMBL968085 1.00 SMPD1 (0.54) SMPD1MEN1KMT2ACNR2
SCHEMBL4531499 0.87 SMPD1 (0.53) SMPD1
SCHEMBL3797840 0.87 SMPD1 (0.53) SMPD1
SCHEMBL31111470 0.87 SMPD1 (0.53) SMPD1
SCHEMBL14085627 0.87 SMPD1 (0.53) SMPD1
SCHEMBL2018917 0.87 SMPD1 (0.53) SMPD1
SCHEMBL31481564 0.87 SMPD1 (0.53) SMPD1
SCHEMBL15731929 0.87 SMPD1 (0.53) SMPD1
SCHEMBL15726531 0.87 SMPD1 (0.53) SMPD1
SCHEMBL2244553 0.85 SMPD1 (0.50) SMPD1CNR2

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-20110009584-A1 Romp-Polymerizable Electron Transport Materials Based On A Bis-Oxadiazole Moiety GEORGIA TECH RESEARCH CORPORATION (US) 2011-01-13 US disclosed
EP-2234991-A1 ROMP-POLYMERIZABLE ELECTRON TRANSPORT MATERIALS BASED ON A BIS-OXADIAZOLE MOIETY Georgia Tech Research Corporation (US) 2010-10-06 EP disclosed
WO-2009080797-A1 ROMP-POLYMERIZABLE ELECTRON TRANSPORT MATERIALS BASED ON A BIS-OXADIAZOLE MOIETY GEORGIA TECH RESEARCH CORPORATION (US) 2009-07-02 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 (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-20110009584-A1 Romp-Polymerizable Electron Transport Materials Based On A Bis-Oxadiazole Moiety SLCO1B3, SLCO4C1, SLCO2B1 SMPD1 4884/4885MEN1 2411/4885KMT2A 4680/4885

“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.