SCHEMBL5457981

SCHEMBL5457981

CCc1nn(C(C)C)c2nc(-c3ccnn3C(C)C)ccc12

nearest known ligand 0.32

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 1/20 0.32
MTOR P42345 1/20 0.32
RICTOR Q6R327 1/20 0.32
RPTOR Q8N122 1/20 0.32
MAPKAP1 Q9BPZ7 1/20 0.32
MLST8 Q9BVC4 1/20 0.32
IDH1 O75874 1/20 0.31
MERTK Q12866 1/20 0.31
NR3C2 P08235 1/20 0.30
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
PDE1A P54750 1/20 0.30
PDE1B Q01064 1/20 0.30
PDE1C Q14123 1/20 0.30
ABL1 P00519 1/20 0.30
HCK P08631 1/20 0.30
SRC P12931 1/20 0.30
NAMPT P43490 1/20 0.30

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
SCHEMBL5351228 0.90 PDE1A (0.36) PIK3CAMTORRICTORRPTORMAPKAP1
SCHEMBL5327319 0.89 CCNK (0.36) PIK3CAMTORRICTORRPTORMAPKAP1
SCHEMBL5365430 0.85 ALDH1A1 (0.39)
SCHEMBL5360675 0.85 PDE1B (0.33) MERTKPDE1APDE1BPDE1CABL1
SCHEMBL5357228 0.82 NT5E (0.34) IDH1NR3C2PDE1APDE1BPDE1C
SCHEMBL5453948 0.82 FFAR4 (0.36) MERTKPDE1APDE1BPDE1CABL1
SCHEMBL5463772 0.81
SCHEMBL5357219 0.81 MAPT (0.38) NR3C2
SCHEMBL5454182 0.81 PDE1B (0.35) MERTKPDE1APDE1BPDE1C
SCHEMBL5468628 0.80 MAPT (0.34)

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-20070254913-A1 Phosphodiesterase 4 inhibitors MEMORY PHARMACEUTICALS CORPORATION 2007-11-01 US claimed
WO-2007123953-A2 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2007-11-01 WO disclosed
US-20070254913-A1 Phosphodiesterase 4 inhibitors MEMORY PHARMACEUTICALS CORPORATION 2007-11-01 US disclosed
US-20070254913-A1 Phosphodiesterase 4 inhibitors MEMORY PHARMACEUTICALS CORPORATION 2007-11-01 US disclosed
US-20070254913-A1 Phosphodiesterase 4 inhibitors MEMORY PHARMACEUTICALS CORPORATION 2007-11-01 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-20070254913-A1 Phosphodiesterase 4 inhibitors PDE4A, PDE4B, PDE12 PIK3CA 1703/4885MTOR 4066/4885RICTOR 2739/4885

“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.