SCHEMBL2829169

SCHEMBL2829169

COc1ccccc1-c1nnc2c3ccccc3c(Nc3ccc(C(N)=O)cc3)nn12

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDR P35968 7/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
PDE2A O00408 1/20 0.46
RXFP1 Q9HBX9 2/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALDH1A1 P00352 3/20 0.43
HPGD P15428 1/20 0.43
EGFR P00533 1/20 0.42
POLB P06746 1/20 0.42
BRAF P15056 1/20 0.42
HTT P42858 1/20 0.42
THRB P10828 1/20 0.41

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
SCHEMBL2824855 0.90 MAPT (0.44) KDRMEN1KMT2APDE2ARXFP1
SCHEMBL496930 0.88 PDE2A (0.51) PDE2ARXFP1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL2828064 0.85 PDE2A (0.51) KDRMEN1KMT2APDE2ARXFP1
SCHEMBL2824919 0.84 KDR (0.64) KDRMEN1KMT2ARAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL2828806 0.83 KDR (0.63) KDRMEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL496593 0.82 PDE2A (0.46) PDE2ARXFP1ALDH1A1HPGDTHRB
SCHEMBL2823870 0.82 PDE2A (0.46) KDRMEN1KMT2APDE2ARXFP1
SCHEMBL496760 0.81 RXFP1 (0.46) KDRPDE2ARXFP1ALDH1A1HPGD
SCHEMBL2826130 0.77 MAPT (0.46) KDRPDE2ARXFP1POLB
SCHEMBL2830725 0.77 MAPT (0.52) KDRMEN1KMT2ARXFP1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7851472-B2 Triazolophthalazines NYCOMED GMBH (DE) 2010-12-14 US disclosed
EP-1791543-B1 TRIAZOLOPHTHALAZINES NYCOMED GMBH (DE) 2010-06-16 EP disclosed
US-20090005372-A1 Triazolophthalazines ALTANA PHARMA AG (DE) 2009-01-01 US disclosed
EP-1791543-A2 TRIAZOLOPHTHALAZINES Altana Pharma AG (DE) 2007-06-06 EP disclosed
WO-2006024640-A2 TRIAZOLOPHTHALAZINES ALTANA PHARMA AG (DE) 2006-03-09 WO 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-20090005372-A1 Triazolophthalazines PDE2A, PDE12, PDE3A KDR 1654/4885MEN1 2920/4885KMT2A 1624/4885

“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.