SCHEMBL6204720

SCHEMBL6204720

Cc1cccc(-n2ncc3c(NN)ncnc32)c1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 15/20 0.74
RAB9A P51151 11/20 0.74
LMNA P02545 9/20 0.74
NPC1 O15118 9/20 0.74
HSD17B10 Q99714 8/20 0.74
SMN1; SMN2 Q16637 8/20 0.74
HTT P42858 7/20 0.74
TP53 P04637 4/20 0.74
TSHR P16473 2/20 0.74
ALDH1A1 P00352 9/20 0.71
MAPT P10636 9/20 0.71
GAA P10253 2/20 0.71
NPSR1 Q6W5P4 5/20 0.70
BLM P54132 1/20 0.70
HPGD P15428 9/20 0.68
MEN1 O00255 5/20 0.68
KMT2A Q03164 5/20 0.68
NFKB1 P19838 1/20 0.67
MAPK1 P28482 1/20 0.67
NFKB2 Q00653 1/20 0.67

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
SCHEMBL6203816 0.85 MAPT (0.68) KDM4ERAB9ALMNANPC1HSD17B10
SCHEMBL6206404 0.85 LMNA (0.71) KDM4ERAB9ALMNANPC1HSD17B10
SCHEMBL6204905 0.85 MAPT (0.71) KDM4ELMNAHSD17B10HTTTP53
SCHEMBL6275801 0.85 LMNA (0.71) KDM4ERAB9ALMNANPC1HSD17B10
SCHEMBL8344591 0.84 LMNA (0.74) KDM4ERAB9ALMNANPC1HSD17B10
SCHEMBL6364028 0.84 KDM4E (1.00) KDM4ERAB9ALMNANPC1HSD17B10
SCHEMBL8342647 0.83 KDM4E (0.65) KDM4ERAB9ALMNANPC1HSD17B10
SCHEMBL13790393 0.83 NPC1 (1.00) KDM4ERAB9ALMNANPC1HSD17B10
Hydrochloric Acid SCHEMBL6363785 0.82 KDM4E (0.97) KDM4ERAB9ALMNANPC1HSD17B10
SCHEMBL8344682 0.82 MAPT (0.64) KDM4ERAB9ALMNANPC1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1551841-A1 PYRAZOLOPYRIMIDINES AS KINASE INHIBITORS SmithKline Beecham Corporation (US) 2005-07-13 EP disclosed
WO-2004009602-A1 PYRAZOLOPYRIMIDINES AS KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2004-01-29 WO disclosed
WO-2004009602-A1 PYRAZOLOPYRIMIDINES AS KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2004-01-29 WO disclosed