SCHEMBL2569587

SCHEMBL2569587

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

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MET P08581 20/20 1.00
PDE3B Q13370 3/20 1.00
PDE3A Q14432 3/20 1.00
PDE4C Q08493 2/20 1.00
PDE4D Q08499 2/20 1.00
CYP2C9 P11712 1/20 0.67
PDE10A Q9Y233 1/20 0.67
KIT P10721 1/20 0.56
SRC P12931 1/20 0.56
PDGFRA P16234 1/20 0.56
AXL P30530 1/20 0.56
KDR P35968 1/20 0.56
MST1R Q04912 1/20 0.56

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
SCHEMBL2569352 1.00 MET (1.00) METPDE3BPDE3APDE4CPDE4D
SCHEMBL2573215 1.00 MET (1.00) METPDE3BPDE3APDE4CPDE4D
SCHEMBL1329580 0.90 MET (0.81) METPDE3BPDE3APDE4CPDE4D
SCHEMBL12489793 0.90 MET (0.81) METPDE3BPDE3APDE4CPDE4D
SCHEMBL12489756 0.90 MET (0.81) METPDE3BPDE3APDE4CPDE4D
SCHEMBL2568394 0.88 MET (1.00) METPDE3BPDE3APDE4CPDE4D
SCHEMBL2572042 0.88 MET (1.00) METPDE3BPDE3APDE4CPDE4D
SCHEMBL2571767 0.88 MET (1.00) METPDE3BPDE3APDE4CPDE4D
SCHEMBL27988607 0.85 MET (0.75) METPDE3BPDE3APDE4CPDE4D
SCHEMBL12689808 0.84 MET (0.72) METPDE3BPDE3APDE4CPDE4D

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 2876/4885PDE3B 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.