SCHEMBL2828627

SCHEMBL2828627

COc1ccc(-c2nnc3c4ccccc4c(Nc4ccc(NC(=O)c5cccnc5)cc4)nn23)cc1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
LMNA P02545 2/20 0.50
RAB9A P51151 2/20 0.50
NPC1 O15118 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
KMT2A Q03164 3/20 0.49
POLB P06746 2/20 0.49
TSHR P16473 2/20 0.48
BRCA1 P38398 1/20 0.48
TP53 P04637 1/20 0.48
ABCG2 Q9UNQ0 1/20 0.46
KDM4E B2RXH2 1/20 0.45
MEN1 O00255 1/20 0.45
HTT P42858 1/20 0.45
HSD17B10 Q99714 1/20 0.45
CYP3A4 P08684 1/20 0.45

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
SCHEMBL2823796 0.93 SMN1; SMN2 (0.53) MAPTSMN1; SMN2LMNARAB9ANPC1
SCHEMBL2828040 0.91 MAPT (0.55) MAPTSMN1; SMN2LMNARAB9ANPC1
SCHEMBL2827702 0.90 MAPT (0.53) MAPTSMN1; SMN2LMNARAB9ANPC1
SCHEMBL2828235 0.90 MAPT (0.56) MAPTSMN1; SMN2LMNARAB9ANPC1
SCHEMBL2825724 0.90 MAPT (0.56) MAPTSMN1; SMN2LMNARAB9ANPC1
SCHEMBL2827930 0.89 ALDH1A1 (0.53) MAPTSMN1; SMN2LMNARAB9ANPC1
SCHEMBL2825532 0.88 MAPT (0.54) MAPTSMN1; SMN2LMNARAB9ANPC1
SCHEMBL2829812 0.88 MAPT (0.52) MAPTSMN1; SMN2LMNARAB9ANPC1
SCHEMBL2825452 0.87 MAPT (0.54) MAPTSMN1; SMN2LMNARAB9ANPC1
SCHEMBL2825894 0.85 MAPT (0.51) MAPTSMN1; SMN2LMNARAB9ANPC1

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 MAPT 3816/4885SMN1; SMN2 2985/4885LMNA 3740/4885
US-20090005372-A1 Triazolophthalazines PDE2A, PDE12, PDE3A MAPT 3816/4885SMN1; SMN2 2985/4885LMNA 3740/4885

“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.