SCHEMBL4884888

SCHEMBL4884888

CC(C)(C)OC(=O)NNc1ccc(C(N)=O)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
KMT2A Q03164 3/20 0.44
MEN1 O00255 1/20 0.44
SMN1; SMN2 Q16637 5/20 0.44
ALDH1A1 P00352 4/20 0.44
MAPK1 P28482 1/20 0.44
GPR119 Q8TDV5 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
MAPT P10636 1/20 0.41
PARP10 Q53GL7 3/20 0.41
PARP4 Q9UKK3 2/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
PARP1 P09874 1/20 0.41
PARP2 Q9UGN5 1/20 0.41
CYP17A1 P05093 1/20 0.40
MIF P14174 1/20 0.40
NAMPT P43490 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
SCHEMBL1414807 0.85 MAPT (0.52) GAANPC1RAB9AKMT2AMEN1
SCHEMBL15600318 0.84 CA1 (0.50) GAANPC1RAB9AKMT2AMEN1
SCHEMBL5394826 0.83 SMN1; SMN2 (0.58) NPC1RAB9AKMT2ASMN1; SMN2ALDH1A1
SCHEMBL2227784 0.83 GAA (0.47) GAANPC1RAB9AKMT2AMEN1
SCHEMBL8196446 0.81 CYP17A1 (0.51) GAANPC1RAB9AKMT2AMEN1
SCHEMBL28578217 0.81 GAA (0.54) GAANPC1RAB9AKMT2AMEN1
SCHEMBL14518047 0.81 GAA (0.50) GAANPC1RAB9AKMT2AMEN1
SCHEMBL24508230 0.81 GAA (0.45) GAANPC1RAB9AKMT2AMEN1
SCHEMBL13167921 0.80 GAA (0.54) GAANPC1RAB9AKMT2AMEN1
SCHEMBL24865580 0.80 GAA (0.53) GAANPC1RAB9AKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080293711-A1 Chemokine receptor modulators METASTATIX, INC. 2008-11-27 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-20080293711-A1 Chemokine receptor modulators CCR5, CCL2, CXCR4 GAA 4547/4885NPC1 363/4885RAB9A 1363/4885

“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.