SCHEMBL14536378

SCHEMBL14536378

Cc1cnc(Nc2ccc(OC3CCNCC3)cc2)nc1N

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ROCK1 Q13464 1/20 0.46
▸ JAK2 O60674 1/20 0.44
▸ JAK1 P23458 1/20 0.44
▸ TYK2 P29597 1/20 0.44
▸ JAK3 P52333 1/20 0.44
▸ IKBKB O14920 1/20 0.43
▸ SYK P43405 4/20 0.41
▸ TYRO3 Q06418 2/20 0.41
▸ AXL P30530 2/20 0.41
▸ AURKA O14965 2/20 0.41
▸ HRH1 P35367 1/20 0.40
▸ PDGFRB P09619 1/20 0.40
▸ PDGFRA P16234 1/20 0.40
▸ CAMK2D Q13557 1/20 0.40
▸ IGF1R P08069 1/20 0.40
▸ KCNH2 Q12809 1/20 0.40
▸ STK17A Q9UEE5 1/20 0.39

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
SCHEMBL266257 0.85 SYK (0.48) ROCK1JAK2JAK1TYK2JAK3
SCHEMBL264663 0.85 JAK2 (0.42) ROCK1JAK2JAK1TYK2JAK3
SCHEMBL270515 0.83 SYK (0.51) JAK2JAK1JAK3IKBKBSYK
Hydrochloric Acid SCHEMBL263896 0.82 SYK (0.50) JAK2JAK1JAK3IKBKBSYK
SCHEMBL264522 0.81 CAMK2D (0.48) JAK2JAK1TYK2JAK3AXL
SCHEMBL270503 0.81 JAK2 (0.56) JAK2JAK1JAK3SYKTYRO3
SCHEMBL266088 0.80 BRD4 (0.56) TYRO3AXLAURKAPDGFRBPDGFRA
SCHEMBL270122 0.79 AXL (0.46) JAK2JAK1TYK2JAK3SYK
SCHEMBL265568 0.79 SOS1 (0.45) JAK2JAK1TYK2JAK3SYK
Hydrochloric Acid SCHEMBL266775 0.78 AXL (0.46) JAK2JAK1TYK2JAK3SYK

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
WO-2007053452-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES TARGEGEN, INC. (US) 2007-05-10 — — WO disclosed
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