SCHEMBL6288550

SCHEMBL6288550

COc1ccc(-c2nc(-n3cncn3)c3c(C)nc(C)n3n2)cc1Cl

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRM7 Q14831 3/20 0.41
S1PR1 P21453 1/20 0.38
HRH4 Q9H3N8 1/20 0.35
XPO1 O14980 1/20 0.34
TP53 P04637 1/20 0.33
PLAT P00750 1/20 0.33
MAPT P10636 1/20 0.33
GSK3A P49840 1/20 0.33
GSK3B P49841 1/20 0.33
KCNJ5 P48544 1/20 0.33
KCNJ3 P48549 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
KMT2A Q03164 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
SCHEMBL6288587 0.92 GRM7 (0.44) GRM7TP53MAPTNPC1
SCHEMBL6288552 0.86 GRM7 (0.38) GRM7S1PR1HRH4XPO1TP53
SCHEMBL6288630 0.86 S1PR1 (0.38) GRM7S1PR1HRH4XPO1MAPT
SCHEMBL6291459 0.85 S1PR1 (0.37) GRM7S1PR1HRH4XPO1TP53
SCHEMBL6288657 0.83 SMN1; SMN2 (0.42) TP53MAPTNPC1KMT2A
SCHEMBL6291399 0.81 POLB (0.37) TP53MAPTMEN1NPC1KMT2A
SCHEMBL6288381 0.81 LMNA (0.34) TP53MAPTGSK3BKCNJ5KCNJ3
SCHEMBL6291832 0.80 GRM7 (0.41) GRM7TP53MAPTNPC1
SCHEMBL6291757 0.80 GRM7 (0.41) GRM7MAPTMEN1KMT2A
SCHEMBL5916392 0.80 PDE2A (0.36) GSK3B

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 2512/4885S1PR1 2809/4885HRH4 2306/4885

“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.