SCHEMBL7366385

SCHEMBL7366385

CN(C)c1ccc(C(=O)c2cnn3c(-c4cccnc4)ccnc23)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 1/20 0.49
CLK4 Q9HAZ1 1/20 0.49
DYRK1B Q9Y463 1/20 0.49
TLR8 Q9NR97 1/20 0.47
KDM4E B2RXH2 4/20 0.44
ALDH1A1 P00352 2/20 0.44
BRAF P15056 1/20 0.43
PIM1 P11309 3/20 0.43
LIMK1 P53667 2/20 0.43
GSK3A P49840 3/20 0.42
GAA P10253 2/20 0.42
EPHA2 P29317 1/20 0.42
MAPK13 O15264 1/20 0.42
MARK2 Q7KZI7 1/20 0.42
AKT1 P31749 1/20 0.42
PIM3 Q86V86 1/20 0.42
MAPT P10636 1/20 0.42
ABL1 P00519 1/20 0.42
BCR P11274 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL7362685 0.88 ALDH1A1 (0.49) MAP2K1CLK4DYRK1BTLR8KDM4E
SCHEMBL7362717 0.88 TLR8 (0.55) MAP2K1CLK4DYRK1BTLR8KDM4E
SCHEMBL7361400 0.87 CLK4 (0.62) MAP2K1CLK4DYRK1BTLR8KDM4E
SCHEMBL7366580 0.87 MAP2K1 (0.55) MAP2K1CLK4DYRK1BTLR8KDM4E
SCHEMBL7360098 0.85 MAP2K1 (0.56) MAP2K1CLK4DYRK1BTLR8KDM4E
SCHEMBL7362153 0.85 KDM4E (0.64) MAP2K1CLK4DYRK1BTLR8KDM4E
SCHEMBL7402736 0.82 KDM4E (0.67) TLR8KDM4EBRAF
SCHEMBL7365839 0.81 KDM4E (0.50) MAP2K1CLK4DYRK1BTLR8KDM4E
SCHEMBL7365603 0.81 TLR8 (0.54) MAP2K1CLK4DYRK1BTLR8KDM4E
SCHEMBL11167079 0.81 MAP2K1 (0.59) MAP2K1CLK4DYRK1BTLR8KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0129847-A2 Aryl and heteroaryl[7-(aryl and heteroaryl)-pyrazolo-[1,5-a]-pyrimidin-3-yl]methanones AMERICAN CYANAMID COMPANY (US) 1985-01-02 EP disclosed