SCHEMBL2572042

SCHEMBL2572042

C[C@H](c1ccc2ncccc2c1)n1nnc2ncc(-c3cnn(C)c3)nc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MET P08581 20/20 1.00
PDE4C Q08493 2/20 1.00
PDE4D Q08499 2/20 1.00
PDE3B Q13370 2/20 1.00
PDE3A Q14432 2/20 1.00
NQO2 P16083 1/20 0.67

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
SCHEMBL2571767 1.00 MET (1.00) METPDE4CPDE4DPDE3BPDE3A
SCHEMBL2568394 1.00 MET (1.00) METPDE4CPDE4DPDE3BPDE3A
SCHEMBL2569352 0.88 MET (1.00) METPDE4CPDE4DPDE3BPDE3A
SCHEMBL2573215 0.88 MET (1.00) METPDE4CPDE4DPDE3BPDE3A
SCHEMBL2569587 0.88 MET (1.00) METPDE4CPDE4DPDE3BPDE3A
SCHEMBL29869924 0.88 MET (1.00) METPDE4CPDE4DPDE3BPDE3A
SCHEMBL29870121 0.84 MET (0.74) METPDE4CPDE4DPDE3BPDE3A
SCHEMBL28864803 0.84 MET (0.74) METPDE4CPDE4DPDE3BPDE3A
SCHEMBL28635903 0.83 MET (0.71) METPDE4CPDE4DPDE3BPDE3A
SCHEMBL29869947 0.83 MET (0.79) METPDE4CPDE4DPDE3BPDE3A

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 13 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
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-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
EP-2018383-A1 TRIAZOLOPYRAZINE DERIVATIVES USEFUL AS ANTI-CANCER AGENTS Pfizer Products Inc. (US) 2009-01-28 EP disclosed
WO-2007132308-A1 TRIAZOLOPYRAZINE DERIVATIVES USEFUL AS ANTI-CANCER AGENTS PFIZER PRODUCTS INC. (US) 2007-11-22 WO 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
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 2876/4885PDE4C 1569/4885PDE4D 1158/4885
US-20100105656-A1 TRIAZOLOPYRAZINE DERIVATIVES JAK2, ABL1, CCND2 MET 2876/4885PDE4C 1569/4885PDE4D 1158/4885

“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.