SCHEMBL2911313

SCHEMBL2911313

CCOC(=O)CCCC1c2cccc(C#N)c2OCCN1C(=O)OC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
GPR119 Q8TDV5 2/20 0.33
UCHL1 P09936 2/20 0.33
CASR P41180 1/20 0.32
NR1H2 P55055 1/20 0.32
NR1H3 Q13133 1/20 0.32
RET P07949 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
NLRP3 Q96P20 1/20 0.32
RIPK1 Q13546 2/20 0.31
SSTR4 P31391 1/20 0.31
TNF P01375 1/20 0.31
TBXAS1 P24557 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL2917440 0.90 MEN1 (0.38) ATMMEN1KMT2AGPR119UCHL1
SCHEMBL2918069 0.86 ATM (0.38) ATMMEN1KMT2AGPR119UCHL1
SCHEMBL2915748 0.86 ATM (0.40) ATMMEN1KMT2AGPR119UCHL1
SCHEMBL2917879 0.83 MEN1 (0.38) ATMMEN1KMT2AL3MBTL1TBXAS1
SCHEMBL13091501 0.83 MEN1 (0.37) ATMMEN1KMT2AL3MBTL1TBXAS1
SCHEMBL2910076 0.82 MEN1 (0.36) ATMMEN1KMT2AGPR119UCHL1
SCHEMBL2910069 0.82 MEN1 (0.36) ATMMEN1KMT2AGPR119UCHL1
SCHEMBL3087510 0.81 ATM (0.36) ATMMEN1KMT2AGPR119UCHL1
SCHEMBL3755529 0.81 NR1H2 (0.37) MEN1KMT2AGPR119UCHL1CASR
SCHEMBL2909505 0.79 S1PR1 (0.53)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100273770-A1 1, 2, 4 -OXADIAZOLE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASES GLAXO GROUP LIMITED (GB) 2010-10-28 US disclosed
US-20100273770-A1 1, 2, 4 -OXADIAZOLE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASES GLAXO GROUP LIMITED (GB) 2010-10-28 US disclosed
US-20100273770-A1 1, 2, 4 -OXADIAZOLE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASES GLAXO GROUP LIMITED (GB) 2010-10-28 US disclosed
EP-2220077-A1 1, 2, 4 -OXADIAZOLE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASES Glaxo Group Limited (GB) 2010-08-25 EP disclosed
WO-2009080730-A1 1, 2, 4 -OXADIAZOLE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASES GLAXO GROUP LIMITED (GB) 2009-07-02 WO disclosed
WO-2009080730-A1 1, 2, 4 -OXADIAZOLE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASES GLAXO GROUP LIMITED (GB) 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-20100273770-A1 1, 2, 4 -OXADIAZOLE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASES SSB, RORC, OXA1L ATM 4682/4885MEN1 2317/4885KMT2A 3559/4885

“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.