SCHEMBL7023008

SCHEMBL7023008

Cc1ccc(-c2n[c]ncc2-c2ncc[nH]2)c(C)c1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 2/20 0.43
HSP90AB1 P08238 3/20 0.36
LMNA P02545 1/20 0.35
BRD4 O60885 1/20 0.33
MTOR P42345 1/20 0.32
ADK P55263 1/20 0.32
CSNK1A1 P48729 1/20 0.31
TYRO3 Q06418 1/20 0.31
DYRK1B Q9Y463 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
NPBWR1 P48145 1/20 0.31
ALPL P05186 1/20 0.30
CA9 Q16790 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
SMO Q99835 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
SCHEMBL7852651 0.87 HSP90AB1 (0.39) NISCHHSP90AB1BRD4MAPTNPBWR1
SCHEMBL7017603 0.83 NISCH (0.57) NISCHBRD4MTORADKCSNK1A1
SCHEMBL4775732 0.81 NISCH (0.58) NISCHHSP90AB1LMNABRD4MTOR
SCHEMBL29466815 0.81 NISCH (0.58) NISCHHSP90AB1LMNABRD4MTOR
SCHEMBL7026082 0.76 CASP6 (0.38)
SCHEMBL4972450 0.76 GSK3B (0.44) NISCHHSP90AB1MTORADKGAA
SCHEMBL19127750 0.75 NISCH (0.42) NISCHBRD4MTORADK
SCHEMBL7024613 0.74 CSNK1A1 (0.40) NISCHMTORADKCSNK1A1TYRO3
SCHEMBL18952684 0.74 KMT2A (0.43) GAAMAPTNPC1RAB9A
SCHEMBL7844485 0.74 NISCH (0.41) NISCHNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1317433-A2 INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 CHIRON CORPORATION (US) 2003-06-11 EP disclosed
WO-2002020495-A2 INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 CHIRON CORPORATION (US) 2002-03-14 WO disclosed
EP-1087963-A1 INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 Chiron Corporation (US) 2001-04-04 EP disclosed
WO-1999065897-A1 INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 CHIRON CORPORATION (US) 1999-12-23 WO disclosed