SCHEMBL2909445

SCHEMBL2909445

COC(=O)CCC1c2cccc(C(=N)NO)c2OCCN1C(=O)OC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
NR1H2 P55055 3/20 0.31
HDAC8 Q9BY41 1/20 0.31
POLB P06746 1/20 0.31
PARP1 P09874 1/20 0.31
NR1H3 Q13133 2/20 0.30
USP30 Q70CQ3 1/20 0.30
UCHL1 P09936 1/20 0.30

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
SCHEMBL2917879 0.88 MEN1 (0.38) ATMMEN1KMT2APOLBPARP1
SCHEMBL13091514 0.85 ATM (0.35) ATMMEN1KMT2ANR1H2POLB
SCHEMBL2914416 0.85 KMT2A (0.40) ATMMEN1KMT2APOLB
SCHEMBL2918069 0.82 ATM (0.38) ATMMEN1KMT2ANR1H2NR1H3
SCHEMBL2917328 0.74 GHSR (0.36) HDAC8POLBUSP30UCHL1
SCHEMBL30428673 0.73 MTNR1B (0.43) HDAC8
SCHEMBL13091501 0.72 MEN1 (0.37) ATMMEN1KMT2APARP1
SCHEMBL2909472 0.72 NR1H2 (0.38) ATMMEN1KMT2ANR1H2NR1H3
SCHEMBL2984790 0.71 MAPK1 (0.47) NR1H2POLBUSP30
SCHEMBL3074912 0.70 S1PR1 (0.59)

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-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

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.