SCHEMBL851618

SCHEMBL851618

CCOC(=O)N1CCN(C(=O)c2cc(O)cc(Oc3ccc(CNC(=O)OC(C)(C)C)cc3)c2)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.47
SMN1; SMN2 Q16637 4/20 0.46
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
GAA P10253 1/20 0.45
LMNA P02545 3/20 0.44
MAPT P10636 1/20 0.44
NPSR1 Q6W5P4 3/20 0.43
TSHR P16473 2/20 0.43
CYP2C19 P33261 3/20 0.43
POLB P06746 1/20 0.41
NAMPT P43490 1/20 0.41
PLG P00747 1/20 0.41
PRSS1 P07477 1/20 0.41
PRSS2 P07478 1/20 0.41
PRSS3 P35030 1/20 0.41
ST14 Q9Y5Y6 1/20 0.41
HTT P42858 1/20 0.40
HSD17B10 Q99714 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL850954 0.89 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2KMT2AMEN1GAA
SCHEMBL851579 0.87 GPR119 (0.44) ALDH1A1SMN1; SMN2KMT2AMEN1GAA
SCHEMBL851943 0.84 CA12 (0.47) ALDH1A1SMN1; SMN2KMT2AMEN1GAA
SCHEMBL851687 0.84 PRSS1 (0.46) ALDH1A1LMNANAMPTPRSS1PRSS2
SCHEMBL851688 0.82 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2KMT2AMEN1GAA
SCHEMBL851617 0.80 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2KMT2AMEN1GAA
SCHEMBL861713 0.80 PRSS1 (0.43) ALDH1A1SMN1; SMN2KMT2AMEN1GAA
SCHEMBL851372 0.78 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2KMT2AMEN1GAA
SCHEMBL851262 0.78 HSD11B1 (0.45) ALDH1A1KMT2AMEN1LMNAPOLB
SCHEMBL851582 0.76 ST14 (0.47) SMN1; SMN2MAPTTSHRNAMPTPLG

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-20140200225-A1 PROTEASE INHIBITORS ORION CORPORATION (FI) 2014-07-17 US disclosed
EP-2432556-A1 PROTEASE INHIBITORS Orion Corporation (FI) 2012-03-28 EP disclosed
WO-2010133748-A1 PROTEASE INHIBITORS ORION CORPORATION (FI) 2010-11-25 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-20140200225-A1 PROTEASE INHIBITORS SERPINB1, TMPRSS15, PRSS1 ALDH1A1 1252/4885SMN1; SMN2 2076/4885KMT2A 3122/4885

“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.