SCHEMBL496668

SCHEMBL496668

COc1ccc(-c2nnc3c4ccccc4c(Nc4ccc(S(=O)(=O)N5CCOCC5)cc4)nn23)cc1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.59
TP53 P04637 4/20 0.59
ALDH1A1 P00352 6/20 0.54
KDM4E B2RXH2 2/20 0.54
USP2 O75604 2/20 0.54
HSD17B10 Q99714 1/20 0.54
PDE2A O00408 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.50
NPSR1 Q6W5P4 2/20 0.50
NPC1 O15118 1/20 0.50
LMNA P02545 1/20 0.50
RAB9A P51151 1/20 0.50
ENPP3 O14638 1/20 0.49
HPGD P15428 1/20 0.49
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46

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
SCHEMBL496862 0.92 MAPT (0.54) MAPTTP53ALDH1A1KDM4EUSP2
SCHEMBL496574 0.91 MAPT (0.54) MAPTTP53ALDH1A1PDE2ASMN1; SMN2
SCHEMBL2026309 0.87 PDE2A (0.66) MAPTTP53ALDH1A1HSD17B10PDE2A
SCHEMBL496550 0.85 MAPT (0.50) MAPTTP53ALDH1A1PDE2ASMN1; SMN2
SCHEMBL496875 0.85 ENPP3 (0.64) MAPTTP53SMN1; SMN2NPSR1NPC1
SCHEMBL2024771 0.84 MAPT (0.69) MAPTTP53SMN1; SMN2NPSR1NPC1
SCHEMBL496775 0.84 MAPT (0.51) MAPTTP53ALDH1A1KDM4ESMN1; SMN2
SCHEMBL2828751 0.84 HPGD (0.58) MAPTTP53ALDH1A1KDM4EPDE2A
SCHEMBL2030793 0.83 MAPT (0.67) MAPTTP53SMN1; SMN2NPSR1NPC1
SCHEMBL496795 0.83 MAPT (0.52) MAPTTP53ALDH1A1KDM4ESMN1; SMN2

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 10 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 claimed
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 claimed
US-20080312225-A1 Triazolophthalazines NYCOMED GMBH (DE) 2008-12-18 US claimed
EP-1836207-A2 TRIAZOLOPHTHALAZINES AS PDE2-INHIBITORS Nycomed GmbH (DE) 2007-09-26 EP claimed
WO-2006072615-A2 TRIAZOLOPHTHALAZINES AS PDE2-INHIBITORS NYCOMED GMBH (DE) 2006-07-13 WO claimed
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-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
WO-2006072615-A2 TRIAZOLOPHTHALAZINES AS PDE2-INHIBITORS NYCOMED GMBH (DE) 2006-07-13 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-20080312225-A1 Triazolophthalazines PDE2A, PDE3A, PDE12 MAPT 3537/4885TP53 4666/4885ALDH1A1 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.