SCHEMBL2828064

SCHEMBL2828064

NC(=O)c1ccc(Nc2nn3c(-c4ccccc4Br)nnc3c3ccccc23)cc1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.51
KDR P35968 10/20 0.48
ALDH1A1 P00352 1/20 0.44
POLB P06746 1/20 0.44
BRAF P15056 1/20 0.44
HTT P42858 1/20 0.44
ENPP3 O14638 1/20 0.44
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
RXFP1 Q9HBX9 1/20 0.40
MAPT P10636 1/20 0.38

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
SCHEMBL496849 0.87 PDE2A (0.56) PDE2APOLBHTTENPP3RXFP1
SCHEMBL2829169 0.85 KDR (0.49) PDE2AKDRALDH1A1POLBBRAF
SCHEMBL2823870 0.85 PDE2A (0.46) PDE2AKDRALDH1A1POLBBRAF
SCHEMBL496633 0.81 PDE2A (0.51) PDE2APOLBHTTMEN1KMT2A
SCHEMBL496562 0.80 PDE2A (0.48) PDE2APOLBMEN1KMT2ARXFP1
SCHEMBL2824919 0.79 KDR (0.64) KDRALDH1A1HTTMEN1KMT2A
Hydrochloric Acid SCHEMBL2828806 0.78 KDR (0.63) KDRALDH1A1HTTMEN1KMT2A
SCHEMBL2826130 0.78 MAPT (0.46) PDE2AKDRPOLBRXFP1MAPT
SCHEMBL2831892 0.77 MAPT (0.43) PDE2AKDRALDH1A1POLBHTT
SCHEMBL2823225 0.75 KDR (0.51) KDRPOLBRXFP1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7851472-B2 Triazolophthalazines NYCOMED GMBH (DE) 2010-12-14 US disclosed
US-20100286140-A1 TRIAZOLOPHTHALAZINES NYCOMED GMBH (DE) 2010-11-11 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 (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-20100286140-A1 TRIAZOLOPHTHALAZINES PDE2A, PDE12, PDE3A PDE2A 1/4885KDR 1654/4885ALDH1A1 717/4885
US-20090005372-A1 Triazolophthalazines PDE2A, PDE12, PDE3A PDE2A 1/4885KDR 1654/4885ALDH1A1 717/4885

“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.