SCHEMBL851812

SCHEMBL851812

CCOC(=O)c1cc(Oc2ccc(C#N)cc2)cc(Oc2ccc(CNC(=O)OCc3ccccc3)cc2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
PLAU P00749 1/20 0.43
NAMPT P43490 1/20 0.43
MAPK14 Q16539 2/20 0.43
PPARG P37231 1/20 0.43
PPARA Q07869 1/20 0.43
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42
HDAC3 O15379 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC2 Q92769 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
CTSL P07711 1/20 0.42
CTSB P07858 1/20 0.42
CTSS P25774 1/20 0.42
CTSK P43235 1/20 0.42
HPGD P15428 1/20 0.42

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
SCHEMBL851030 0.89 PLAU (0.47) MAPTL3MBTL1SMN1; SMN2PLAUNAMPT
SCHEMBL851481 0.86 PLAU (0.49) MAPTL3MBTL1SMN1; SMN2PLAUNAMPT
SCHEMBL850959 0.84 EPHX2 (0.44) MAPTL3MBTL1NAMPTPPARGPPARA
SCHEMBL851236 0.83 HDAC1 (0.47) L3MBTL1PPARAHDAC1MEN1KMT2A
SCHEMBL27109856 0.82 PLAU (0.60) MAPTL3MBTL1SMN1; SMN2PLAUNAMPT
SCHEMBL851473 0.81 HDAC1 (0.43) MAPTL3MBTL1PLAUNAMPTPPARA
SCHEMBL851619 0.81 RAB9A (0.58) MAPTTDP1
SCHEMBL851271 0.81 PARP15 (0.53) MAPTL3MBTL1SMN1; SMN2LMNAMEN1
SCHEMBL851304 0.79 HDAC1 (0.42) MAPTSMN1; SMN2LMNAHTTHDAC1
SCHEMBL851825 0.79 ALDH1A1 (0.40) MAPK14PPARAHDAC1MEN1KMT2A

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-20140200225-A1 PROTEASE INHIBITORS ORION CORPORATION (FI) 2014-07-17 US disclosed
US-8722930-B2 Protease inhibitors ORION CORPORATION (FI) 2014-05-13 US disclosed
US-20120136002-A1 PROTEASE INHIBITORS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2012-05-31 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 (2 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 MAPT 2785/4885L3MBTL1 1406/4885SMN1; SMN2 2076/4885
US-20120136002-A1 PROTEASE INHIBITORS SERPINB1, TMPRSS15, PRSS1 MAPT 2785/4885L3MBTL1 1406/4885SMN1; SMN2 2076/4885

“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.