SCHEMBL2236717

SCHEMBL2236717

CCOC(=O)NN(C(=O)Oc1ccccc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.53
KMT2A Q03164 4/20 0.53
MEN1 O00255 3/20 0.53
SMN1; SMN2 Q16637 3/20 0.52
PTGES O14684 1/20 0.51
MAPT P10636 3/20 0.50
TDP1 Q9NUW8 3/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
ATM Q13315 1/20 0.49
RAB9A P51151 4/20 0.47
NPC1 O15118 3/20 0.47
HPGD P15428 2/20 0.47
CRHBP P24387 1/20 0.47
CRHR2 Q13324 1/20 0.47
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
ALOX15 P16050 1/20 0.44
MAPK1 P28482 1/20 0.44
CYP2C19 P33261 1/20 0.44

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
SCHEMBL10881230 0.88 ALDH1A1 (0.66) ALDH1A1KMT2AMEN1SMN1; SMN2MAPT
SCHEMBL27619730 0.87 ALDH1A1 (0.58) ALDH1A1KMT2AMEN1SMN1; SMN2MAPT
SCHEMBL2234801 0.85 PTGES (0.56) ALDH1A1KMT2AMEN1SMN1; SMN2PTGES
SCHEMBL5170361 0.83 ALDH1A1 (0.52) ALDH1A1KMT2AMEN1SMN1; SMN2MAPT
SCHEMBL2237995 0.82 HPGD (0.41) ALDH1A1KMT2AMEN1SMN1; SMN2PTGES
SCHEMBL17728318 0.81 ALDH1A1 (0.50) ALDH1A1KMT2AMEN1SMN1; SMN2MAPT
SCHEMBL28651914 0.80 ALDH1A1 (0.56) ALDH1A1KMT2AMEN1SMN1; SMN2MAPT
SCHEMBL2237040 0.80 PTGES (0.48) ALDH1A1KMT2AMEN1SMN1; SMN2PTGES
SCHEMBL27842447 0.79 MTNR1A (0.46) ALDH1A1KMT2AMEN1SMN1; SMN2PTGES
SCHEMBL29048566 0.79 ALDH1A1 (0.69) ALDH1A1KMT2AMEN1SMN1; SMN2MAPT

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-8299264-B2 Method for producing oxadiazolinone compound and intermediate thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-10-30 US disclosed
US-20110207936-A1 METHOD FOR PRODUCING OXADIAZOLINONE COMPOUND AND INTERMEDIATE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-25 US disclosed
EP-2357167-A1 METHOD FOR PRODUCING OXADIAZOLINONE COMPOUND AND INTERMEDIATE THEREOF Sumitomo Chemical Company, Limited (JP) 2011-08-17 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-20110207936-A1 METHOD FOR PRODUCING OXADIAZOLINONE COMPOUND AND INTERMEDIATE THEREOF AHR, CYP1B1, AR ALDH1A1 50/4885KMT2A 1740/4885MEN1 2516/4885

“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.