SCHEMBL5356591

SCHEMBL5356591

CCc1nn(C(C)C)c2nc(-c3ccn(-c4ccccc4)n3)ccc12

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
MAPK1 P28482 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HTT P42858 1/20 0.36
TYK2 P29597 1/20 0.35
CASR P41180 1/20 0.35
KHK P50053 6/20 0.34
NT5E P21589 1/20 0.34
POLB P06746 1/20 0.33
ELOVL1 Q9BW60 3/20 0.32
SRC P12931 2/20 0.32
PDE9A O76083 1/20 0.32
ABL1 P00519 1/20 0.32
HCK P08631 1/20 0.32
MERTK Q12866 1/20 0.32
GAA P10253 1/20 0.31

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
SCHEMBL5322571 0.81 JMJD6 (0.32)
SCHEMBL5368408 0.80
SCHEMBL5365430 0.80 ALDH1A1 (0.39) ALDH1A1MAPK1L3MBTL1KHKNT5E
SCHEMBL5468656 0.76 CARM1 (0.33) KHKSRC
SCHEMBL5457981 0.72 PIK3CA (0.32) SRCABL1HCKMERTK
SCHEMBL5453948 0.70 FFAR4 (0.36) ALDH1A1HTTSRCABL1HCK
SCHEMBL3608704 0.70 PIK3CA (0.35) POLBSRCABL1HCKMERTK
SCHEMBL5351228 0.70 PDE1A (0.36)
SCHEMBL5355113 0.70 NLRP3 (0.40)
SCHEMBL5327319 0.69 CCNK (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007123953-A2 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2007-11-01 WO claimed
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
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 ALDH1A1 515/4885MAPK1 2203/4885L3MBTL1 2798/4885

“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.