SCHEMBL2572054

SCHEMBL2572054

CC(O)Cn1cc(-c2cnc3nnn(Cc4ccc5ncccc5c4)c3n2)cn1

nearest known ligand 0.77

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MET P08581 20/20 0.77
PDE3B Q13370 2/20 0.77
PDE3A Q14432 2/20 0.77
CYP2C9 P11712 1/20 0.77
PDE10A Q9Y233 1/20 0.77
PDE4C Q08493 1/20 0.57
PDE4D Q08499 1/20 0.57

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
SCHEMBL12482432 0.90 MET (0.61) METPDE3BPDE3ACYP2C9PDE10A
SCHEMBL5655130 0.88 MET (0.69) METPDE3BPDE3ACYP2C9PDE10A
Pf-04217903 SCHEMBL29355971 0.87 MET (1.00) METPDE3BPDE3ACYP2C9PDE10A
Pf-04217903 SCHEMBL29394198 0.87 MET (1.00) METPDE3BPDE3ACYP2C9PDE10A
Pf-04217903 SCHEMBL93550 0.87 MET (1.00) METPDE3BPDE3ACYP2C9PDE10A
SCHEMBL16324440 0.87 MET (0.80) METPDE3BPDE3ACYP2C9PDE10A
SCHEMBL2569065 0.86 MET (1.00) METPDE3BPDE3ACYP2C9PDE10A
Pf-04217903 SCHEMBL1178807 0.86 MET (0.98) METPDE3BPDE3ACYP2C9PDE10A
SCHEMBL2573354 0.85 MET (1.00) METPDE3BPDE3ACYP2C9PDE10A
SCHEMBL28630458 0.85 MET (0.78) METPDE3BPDE3ACYP2C9PDE10A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2018383-B1 TRIAZOLOPYRAZINE DERIVATIVES USEFUL AS ANTI-CANCER AGENTS PFIZER PROD INC (US) 2011-11-09 EP disclosed
US-7732604-B2 Triazolopyrazine derivatives PFIZER INC. (US) 2010-06-08 US disclosed
US-7732604-B2 Triazolopyrazine derivatives PFIZER INC. (US) 2010-06-08 US disclosed
US-20100105656-A1 TRIAZOLOPYRAZINE DERIVATIVES PFIZER INC. 2010-04-29 US disclosed
US-20100105656-A1 TRIAZOLOPYRAZINE DERIVATIVES PFIZER INC. 2010-04-29 US disclosed
US-20100105656-A1 TRIAZOLOPYRAZINE DERIVATIVES PFIZER INC. 2010-04-29 US disclosed
US-20070265272-A1 TRIAZOLOPYRAZINE DERIVATIVES PFIZER INC. 2007-11-15 US disclosed
US-20070265272-A1 TRIAZOLOPYRAZINE DERIVATIVES PFIZER INC. 2007-11-15 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 (2 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-20070265272-A1 TRIAZOLOPYRAZINE DERIVATIVES JAK2, ABL1, CCND2 MET 2876/4885PDE3B 1010/4885PDE3A 838/4885
US-20100105656-A1 TRIAZOLOPYRAZINE DERIVATIVES JAK2, ABL1, CCND2 MET 2876/4885PDE3B 1010/4885PDE3A 838/4885

“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.