SCHEMBL634119

SCHEMBL634119

O=C1OC(CN2CC(O)C2)CN1c1ccc2c(c1)OCCO2

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 14/20 0.55
KMT2A Q03164 2/20 0.46
GRK2 P25098 1/20 0.46
CTDSP1 Q9GZU7 1/20 0.46
POLB P06746 1/20 0.42
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
MAPT P10636 1/20 0.41

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
SCHEMBL633011 0.88 SIGMAR1 (0.52) SIGMAR1KMT2AGRK2CTDSP1POLB
SCHEMBL633009 0.88 SIGMAR1 (0.52) SIGMAR1KMT2AGRK2CTDSP1POLB
SCHEMBL1223231 0.84 SIGMAR1 (0.55) SIGMAR1KMT2AGRK2CTDSP1
SCHEMBL1223237 0.84 SIGMAR1 (0.55) SIGMAR1KMT2AGRK2CTDSP1
SCHEMBL591159 0.84 MAOA (0.59) SIGMAR1KMT2AGRK2CTDSP1POLB
SCHEMBL591514 0.84 MAOA (0.59) SIGMAR1KMT2AGRK2CTDSP1POLB
SCHEMBL591161 0.84 MAOA (0.59) SIGMAR1KMT2AGRK2CTDSP1POLB
SCHEMBL1712582 0.81 GRK2 (0.49) SIGMAR1KMT2AGRK2CTDSP1POLB
SCHEMBL2294706 0.81 GRK2 (0.49) SIGMAR1KMT2AGRK2CTDSP1POLB
SCHEMBL632626 0.81 KMT2A (0.48) SIGMAR1KMT2AGRK2CTDSP1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9505750-B2 5-aminocyclylmethyl-oxazolidin-2-one derivatives ACTELION PHARMACEUTICALS LTD. (CH) 2016-11-29 US disclosed
EP-2245028-B1 5-AMINOCYCLYLMETHYL-OXAZOLIDIN-2-ONE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2012-02-22 EP disclosed
US-20110003789-A1 5-AMINOCYCLYLMETHYL-OXAZOLIDIN-2-ONE DERIVATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2011-01-06 US disclosed
EP-2245028-A1 5-AMINOCYCLYLMETHYL-OXAZOLIDIN-2-ONE DERIVATIVES Actelion Pharmaceuticals Ltd. (CH) 2010-11-03 EP disclosed
WO-2009077989-A1 5-AMINOCYCLYLMETHYL-OXAZOLIDIN-2-ONE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2009-06-25 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-20110003789-A1 5-AMINOCYCLYLMETHYL-OXAZOLIDIN-2-ONE DERIVATIVES CNKSR1, KCNH1, CBR3 SIGMAR1 28/4885KMT2A 1674/4885GRK2 2207/4885

“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.