SCHEMBL1199488

SCHEMBL1199488

CC(C)(C)OC(=O)N1C=C(C(=O)O)NC1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 5/20 0.39
KDM4E B2RXH2 2/20 0.36
MAPT P10636 1/20 0.36
THRB P10828 1/20 0.36
MAPK1 P28482 1/20 0.36
ESR2 Q92731 1/20 0.34
ADORA1 P30542 1/20 0.34
PKM P14618 1/20 0.33
KMT2A Q03164 1/20 0.33
USP2 O75604 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PTPN2 P17706 1/20 0.33
PTPN1 P18031 1/20 0.33
PTPN6 P29350 1/20 0.33
NR1H2 P55055 1/20 0.33

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
SCHEMBL12610885 0.73 ESR2 (0.40) GPR119KDM4EMAPK1ESR2ADORA1
SCHEMBL30213616 0.71 KDM4E (0.42) GPR119KDM4EMAPTTHRBMAPK1
SCHEMBL3505154 0.68 ESR2 (0.45) GPR119MAPK1ESR2ADORA1KMT2A
SCHEMBL7420791 0.68 ADORA1 (0.36) GPR119ESR2ADORA1USP2SMN1; SMN2
SCHEMBL3806952 0.66 KDM4E (0.35) GPR119KDM4EMAPTTHRBUSP2
SCHEMBL2980997 0.66 ESR2 (0.43) GPR119KDM4EMAPTTHRBMAPK1
SCHEMBL17481737 0.66 USP2 (0.41) GPR119KDM4EMAPTTHRBMAPK1
SCHEMBL21708919 0.66 USP2 (0.41) GPR119MAPTMAPK1ESR2ADORA1
SCHEMBL2793465 0.65 USP2 (0.37) GPR119KDM4EMAPTTHRBESR2
SCHEMBL20690515 0.65 ALDH1A1 (0.40) GPR119KDM4EMAPTTHRBMAPK1

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-7888351-B2 Organic compounds NOVARTIS AG (CH) 2011-02-15 US disclosed
US-20110034462-A1 ORGANIC COMPOUNDS BAESCHLIN DANIEL KASPAR 2011-02-10 US disclosed
US-20090281069-A1 ORGANIC COMPOUNDS BAESCHLIN DANIEL KASPAR 2009-11-12 US disclosed
CN-101472892-A Organic compounds NOVARTIS AG (CH) 2009-07-01 CN disclosed
EP-2007723-A2 ORGANIC COMPOUNDS Novartis AG (CH) 2008-12-31 EP disclosed
WO-2007115821-A2 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2007-10-18 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-20090281069-A1 ORGANIC COMPOUNDS OTC, OAT, SLCO2B1 GPR119 2772/4885KDM4E 3571/4885MAPT 839/4885
US-20110034462-A1 ORGANIC COMPOUNDS OTC, OAT, SLCO2B1 GPR119 2772/4885KDM4E 3571/4885MAPT 839/4885

“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.