SCHEMBL27943334

SCHEMBL27943334

[CH2]Cn1nc(N(C)C)c2c(N)ncnc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 1/20 0.43
▸ CYP1A2 P05177 3/20 0.39
▸ MAPK1 P28482 3/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ FYN P06241 7/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ SRC P12931 5/20 0.37
▸ YES1 P07947 4/20 0.37
▸ FGR P09769 4/20 0.37
▸ LYN P07948 2/20 0.37
▸ PIK3CD O00329 4/20 0.37
▸ PRKDC P78527 4/20 0.37
▸ ABL1 P00519 3/20 0.36
▸ LCK P06239 1/20 0.36
▸ RET P07949 1/20 0.36
▸ FRK P42685 1/20 0.36

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
SCHEMBL27943325 0.77 PIK3CD (0.40) CYP1A2MAPK1KDM4ETP53CYP3A4
SCHEMBL28406676 0.76 ADK (0.50) CYP1A2MAPK1KDM4ETP53CYP3A4
SCHEMBL27943335 0.72 PIK3CD (0.50) CYP1A2MAPK1KDM4ETP53CYP3A4
SCHEMBL28808532 0.71 LRRK2 (0.42) LRRK2KDM4ESRCYES1FGR
SCHEMBL3785235 0.70 PIK3CD (0.51) MAPK1KDM4EFYNSRCPIK3CD
SCHEMBL27953704 0.70 LRRK2 (0.41) LRRK2SRCYES1FGRPIK3CD
SCHEMBL27943341 0.68 PIK3CD (0.44) CYP1A2MAPK1KDM4ETP53CYP3A4
SCHEMBL27953708 0.68 GAA (0.51) KDM4EMEN1KMT2ASRCYES1
SCHEMBL8324823 0.68 ADK (0.71) —
SCHEMBL27953706 0.67 PIK3CG (0.57) CYP1A2MAPK1KDM4ETP53CYP3A4

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
CN-103702989-A Novel compounds as modulators of protein kinases RHIZEN PHARMACEUTICALS SA 2014-04-02 — — CN claimed
CN-103702989-A Novel compounds as modulators of protein kinases RHIZEN PHARMACEUTICALS SA 2014-04-02 — — CN disclosed
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