SCHEMBL1573672

SCHEMBL1573672

CC(C)(C)OC(=O)N1C[C@@H](C=Cc2ccccc2)[C@@H](O)C1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RORC P51449 3/20 0.44
GPR119 Q8TDV5 1/20 0.43
NAMPT P43490 1/20 0.42
USP30 Q70CQ3 3/20 0.42
KDM4E B2RXH2 1/20 0.40
PKM P14618 1/20 0.40
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
TSHR P16473 1/20 0.39
KMT2A Q03164 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HDAC1 Q13547 1/20 0.39
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38
STS P08842 1/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL3189419 1.00 RORC (0.44) RORCGPR119NAMPTUSP30KDM4E
SCHEMBL2677957 1.00 RORC (0.44) RORCGPR119NAMPTUSP30KDM4E
SCHEMBL4752713 1.00 RORC (0.44) RORCGPR119NAMPTUSP30KDM4E
SCHEMBL30881248 0.86 MAPT (0.44) RORCGPR119USP30HDAC1STS
SCHEMBL4762180 0.83 PDE4B (0.49) RORCGPR119NAMPTUSP30KDM4E
SCHEMBL1014011 0.83 PDE4B (0.49) RORCGPR119NAMPTUSP30KDM4E
SCHEMBL1014009 0.83 PDE4B (0.49) RORCGPR119NAMPTUSP30KDM4E
SCHEMBL4762175 0.83 PDE4B (0.49) RORCGPR119NAMPTUSP30KDM4E
SCHEMBL1014994 0.83 PDE4B (0.49) RORCGPR119NAMPTUSP30KDM4E
SCHEMBL3181295 0.78 NR1H2 (0.44) RORCNAMPTKDM4EMEN1ALDH1A1

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-8173662-B2 Fused pyrimidines as inhibitors of nucleoside phosphorylases and nucleosidases INDUSTRIAL RESEARCH LIMITED (NZ) 2012-05-08 US disclosed
EP-1539783-B1 INHIBITORS OF NUCLEOSIDE PHOSPHORYLASES AND NUCLEOSIDASES EINSTEIN COLL MED (US) 2011-04-13 EP disclosed
US-20090239885-A1 Inhibitors of nucleoside phoshorylases and nucleosidases BIOCRYST PHARMACEUTICALS, INC. 2009-09-24 US disclosed
US-7553839-B2 5h-pyrrolo[3,2-D] pyrimidine inhibitors of nucleoside phosphorylases and nucleosidases INDUSTRIAL RESEARCH LIMITED (NZ) 2009-06-30 US disclosed
US-20060160765-A1 Inhibitors of nucleoside phosphorylases and nucleosidases BIOCRYST PHARMACEUTICALS, INC. 2006-07-20 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 (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-20090239885-A1 Inhibitors of nucleoside phoshorylases and nucleosidases PNP, MTAP, TYMP RORC 1103/4885GPR119 3510/4885NAMPT 14/4885
US-20060160765-A1 Inhibitors of nucleoside phosphorylases and nucleosidases PNP, MTAP, TYMP RORC 1635/4885GPR119 3418/4885NAMPT 15/4885

“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.