SCHEMBL496760

SCHEMBL496760

COc1ccccc1-c1nnc2c3ccccc3c(Nc3cccc(N)c3)nn12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 2/20 0.46
HPGD P15428 2/20 0.45
ALDH1A1 P00352 1/20 0.45
PDE2A O00408 1/20 0.44
RET P07949 1/20 0.43
KDR P35968 1/20 0.43
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.41
THRB P10828 1/20 0.41
GABRG2 P18507 2/20 0.40
GABRB3 P28472 2/20 0.40
GABRA5 P31644 2/20 0.40
JAK2 O60674 1/20 0.40
GABRA1 P14867 1/20 0.40
GABRA3 P34903 1/20 0.40
GABRA2 P47869 1/20 0.40
SHMT2 P34897 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
ABCG2 Q9UNQ0 1/20 0.39

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
SCHEMBL496930 0.88 PDE2A (0.51) RXFP1HPGDALDH1A1PDE2ATP53
SCHEMBL496632 0.87 MAPT (0.50) RXFP1ALDH1A1PDE2ATP53MAPT
SCHEMBL2824855 0.86 MAPT (0.44) RXFP1HPGDALDH1A1PDE2AKDR
SCHEMBL496538 0.84 ABCG2 (0.58) RXFP1HPGDALDH1A1MAPTABCG2
SCHEMBL496563 0.84 PDE2A (0.46) RXFP1ALDH1A1PDE2ATP53MAPT
SCHEMBL496562 0.84 PDE2A (0.48) RXFP1PDE2ATP53MAPT
SCHEMBL2825175 0.84 PDE2A (0.61) RXFP1ALDH1A1PDE2ATP53MAPT
SCHEMBL496586 0.83 MAPT (0.60) TP53MAPTGABRG2GABRB3GABRA5
SCHEMBL496542 0.83 PDE2A (0.44) RXFP1PDE2ATP53MAPTGABRG2
SCHEMBL496764 0.81 PDE2A (0.44) PDE2AKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1836207-B1 TRIAZOLOPHTHALAZINES AS PDE2-INHIBITORS NYCOMED GMBH (DE) 2012-10-10 EP disclosed
US-8106047-B2 (4-Methoxyphenyl)-[3-(4-methoxyphenyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-yl]-amine; phosphodiesterase inhibitors; septic shock or vascular edema; neoangiogenesis or inflammatory disease NYCOMED GMBH (DE) 2012-01-31 US disclosed
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
US-20080312225-A1 Triazolophthalazines NYCOMED GMBH (DE) 2008-12-18 US disclosed
EP-1836207-A2 TRIAZOLOPHTHALAZINES AS PDE2-INHIBITORS Nycomed GmbH (DE) 2007-09-26 EP disclosed
EP-1791543-A2 TRIAZOLOPHTHALAZINES Altana Pharma AG (DE) 2007-06-06 EP disclosed
WO-2006072615-A2 TRIAZOLOPHTHALAZINES AS PDE2-INHIBITORS NYCOMED GMBH (DE) 2006-07-13 WO 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 (3 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 RXFP1 223/4885HPGD 341/4885ALDH1A1 717/4885
US-20090005372-A1 Triazolophthalazines PDE2A, PDE12, PDE3A RXFP1 223/4885HPGD 341/4885ALDH1A1 717/4885
US-20080312225-A1 Triazolophthalazines PDE2A, PDE3A, PDE12 RXFP1 292/4885HPGD 585/4885ALDH1A1 920/4885

“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.