SCHEMBL209368

SCHEMBL209368

CC(C)(C)OC(=O)N1CCN(Cc2ccc(C(F)(F)F)nc2)CC1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 2/20 0.59
MGLL Q99685 2/20 0.50
GPR119 Q8TDV5 11/20 0.48
PPARA Q07869 1/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
ATM Q13315 1/20 0.47
VEGFA P15692 1/20 0.46
EGLN1 Q9GZT9 1/20 0.46
KCNH2 Q12809 1/20 0.45
PLA2G7 Q13093 1/20 0.45
ABHD6 Q9BV23 1/20 0.45
IDO1 P14902 1/20 0.44
TDO2 P48775 1/20 0.44
IDO2 Q6ZQW0 1/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA4 P22748 1/20 0.43
CA5A P35218 1/20 0.43

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
SCHEMBL21608013 0.93 PPARD (0.54) PPARDMGLLGPR119PPARAMEN1
SCHEMBL25291826 0.87 PPARD (0.51) PPARDMGLLGPR119PPARAMEN1
SCHEMBL114519 0.86 VEGFA (0.50) MGLLGPR119MEN1KMT2AATM
SCHEMBL30520640 0.84 MEN1 (0.50) GPR119MEN1KMT2AATMVEGFA
SCHEMBL1997213 0.83 MEN1 (0.49) GPR119MEN1KMT2AATMVEGFA
SCHEMBL30584532 0.83 MEN1 (0.49) GPR119MEN1KMT2AATMVEGFA
SCHEMBL12557699 0.83 KMT2A (0.69) MGLLGPR119MEN1KMT2AATM
SCHEMBL30042412 0.83 MEN1 (0.49) GPR119MEN1KMT2AATMVEGFA
SCHEMBL2933302 0.83 MEN1 (0.49) GPR119MEN1KMT2AATMVEGFA
SCHEMBL209525 0.83 PPARD (0.59) PPARDMGLLGPR119PPARAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1963315-B1 ENZYME INHIBITORS CANCER REC TECH LTD (GB) 2014-10-08 EP disclosed
WO-2012019430-A1 PHTHALAZINONE DERIVATIVE, AND PREPARATION METHOD AND PHARMACEUTICAL USE THEREOF 上海恒瑞医药有限公司 (CN) 2012-02-16 WO disclosed
US-8088761-B2 Enzyme inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2012-01-03 US disclosed
US-8088761-B2 Enzyme inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2012-01-03 US disclosed
US-8088761-B2 Enzyme inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2012-01-03 US disclosed
US-20090247507-A1 Enzyme Inhibitors THE INSTITUTE OF CANCER RESEARCH (GB) 2009-10-01 US disclosed
US-20090247507-A1 Enzyme Inhibitors THE INSTITUTE OF CANCER RESEARCH (GB) 2009-10-01 US disclosed
US-20090247507-A1 Enzyme Inhibitors THE INSTITUTE OF CANCER RESEARCH (GB) 2009-10-01 US 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-20090247507-A1 Enzyme Inhibitors AURKC, AURKB, AURKA PPARD 4781/4885MGLL 4147/4885GPR119 3926/4885

“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.