SCHEMBL4373960

SCHEMBL4373960

Cc1cnc2[nH]c(C(C)(C)C)cc2c1Cl

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ AXL P30530 1/20 0.47
▸ PRKCI P41743 1/20 0.47
▸ DAO P14920 1/20 0.35
▸ DDO Q99489 1/20 0.35
▸ IKBKB O14920 2/20 0.34
▸ CHUK O15111 2/20 0.34
▸ RET P07949 1/20 0.32
▸ KDR P35968 1/20 0.32
▸ PDE3B Q13370 1/20 0.31
▸ PDE3A Q14432 1/20 0.31
▸ MAP3K14 Q99558 1/20 0.30

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
SCHEMBL15962870 0.82 AXL (0.53) AXLPRKCIDAODDOIKBKB
SCHEMBL26262641 0.74 RET (0.42) RETKDR
SCHEMBL13507207 0.72 IKBKB (0.46) IKBKBCHUKRETKDR
SCHEMBL3413744 0.71 IKBKB (0.45) AXLPRKCIDAOIKBKBCHUK
SCHEMBL31420487 0.71 IKBKB (0.45) AXLPRKCIDAOIKBKBCHUK
SCHEMBL16908345 0.70 IKBKB (0.35) IKBKBCHUK
SCHEMBL16977985 0.68 KIT (0.54) AXLPRKCI
SCHEMBL25449356 0.67 PI4KA (0.40) IKBKBCHUKRETKDR
SCHEMBL4050239 0.67 CCR1 (0.39) RETKDR
SCHEMBL25666628 0.67 IKBKB (0.36) IKBKBCHUKKDR

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
WO-2009112473-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2009-09-17 — — WO disclosed
WO-2009112473-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2009-09-17 — — WO disclosed
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