SCHEMBL6288364

SCHEMBL6288364

CCC(C)c1nc(C)c2c(-n3cncn3)nc(-c3ccc(OC)c(OC)c3)nn12

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRM7 Q14831 3/20 0.39
MAPT P10636 3/20 0.33
CRHR1 P34998 2/20 0.33
PDE2A O00408 2/20 0.33
LMNA P02545 2/20 0.33
TP53 P04637 1/20 0.33
TDP2 O95551 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
CSNK1D P48730 1/20 0.33

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
SCHEMBL6291459 0.93 S1PR1 (0.37) GRM7MAPTCRHR1PDE2ATP53
SCHEMBL6291398 0.92 GRM7 (0.40) GRM7MAPTCRHR1PDE2ALMNA
SCHEMBL6291832 0.91 GRM7 (0.41) GRM7MAPTLMNATP53TDP2
SCHEMBL6288428 0.86 MAPT (0.31) MAPTTP53ALDH1A1
SCHEMBL6288552 0.85 GRM7 (0.38) GRM7MAPTCRHR1TP53
SCHEMBL6288587 0.84 GRM7 (0.44) GRM7MAPTLMNATP53TDP2
SCHEMBL6291757 0.79 GRM7 (0.41) GRM7MAPTLMNATDP2ALDH1A1
SCHEMBL6291357 0.79 SMN1; SMN2 (0.39) MAPTTP53ALDH1A1
SCHEMBL6288630 0.78 S1PR1 (0.38) GRM7MAPT
SCHEMBL6291873 0.77 MAPT (0.31) MAPTLMNATP53ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6936609-B2 Imidazotriazines for use as phosphodiesterase inhibitors BAYER HEALTHCARE AG (DE) 2005-08-30 US disclosed
US-20040249148-A1 Imidazotriazines for use as phosphodiesterase inhibitors BAYER HEALTHCARE AG (DE) 2004-12-09 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-20040249148-A1 Imidazotriazines for use as phosphodiesterase inhibitors PDE3A, PDE2A, PDE4A GRM7 2512/4885MAPT 1159/4885CRHR1 3800/4885

“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.