SCHEMBL6205850

SCHEMBL6205850

Oc1ncnc2c1cnn2-c1cccc(Cl)c1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TP53 P04637 13/20 0.62
MAPT P10636 12/20 0.62
LMNA P02545 9/20 0.58
TDP1 Q9NUW8 1/20 0.57
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
KDM4E B2RXH2 1/20 0.56
ALDH1A1 P00352 1/20 0.56
GAA P10253 1/20 0.56
HPGD P15428 1/20 0.56
TSHR P16473 1/20 0.56
HTT P42858 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
HSD17B10 Q99714 1/20 0.56

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
SCHEMBL6224500 0.86 MAPT (0.65) TP53MAPTLMNATDP1MEN1
SCHEMBL3879802 0.83 KDM4E (0.71) TP53MAPTLMNATDP1MEN1
SCHEMBL6207703 0.83 SLC2A1 (0.58) TP53MAPTLMNAMEN1KMT2A
SCHEMBL8345368 0.83 TP53 (0.63) TP53MAPTLMNATDP1MEN1
SCHEMBL6204755 0.83 GSK3B (0.54) TP53MAPTLMNAMEN1KMT2A
SCHEMBL31337054 0.82 ALDH1A1 (0.67) TP53MAPTLMNATDP1MEN1
SCHEMBL6282033 0.82 ALDH1A1 (0.67) TP53MAPTLMNATDP1MEN1
SCHEMBL6206486 0.81 GSK3B (0.60) MAPTLMNAMEN1KMT2AKDM4E
SCHEMBL6206071 0.81 XDH (0.53) TP53MAPTLMNAMEN1KMT2A
SCHEMBL6204905 0.80 MAPT (0.71) TP53MAPTLMNAMEN1KMT2A

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 2 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