SCHEMBL5554780

SCHEMBL5554780

CCCCCCCCN(CCCCCCCC)c1ccc(C(c2ccc(N(CCCCCCCC)CCCCCCCC)cc2C)c2ccc(N(CCCCCCCC)CCCCCCCC)cc2C)c(C)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.51
GAA P10253 2/20 0.51
PKM P14618 1/20 0.51
HTT P42858 1/20 0.51
MCL1 Q07820 1/20 0.51
S100B P04271 1/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
SLC16A3 O15427 1/20 0.35
SLC16A1 P53985 1/20 0.35
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 2/20 0.35
POLB P06746 1/20 0.35
AR P10275 1/20 0.35
CNR2 P34972 3/20 0.33
PTPN11 Q06124 1/20 0.33
PTPRO Q16827 1/20 0.33
NPC1 O15118 1/20 0.33
TP53 P04637 1/20 0.33
GPX4 P36969 1/20 0.33

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
SCHEMBL3906205 1.00 MAPT (0.51) MAPTGAAPKMHTTMCL1
SCHEMBL10514028 0.89 GAA (0.48) MAPTGAAPKMHTTMCL1
SCHEMBL3906212 0.87 GAA (0.39) MAPTGAAPKMHTTMCL1
SCHEMBL5554784 0.87 GAA (0.39) MAPTGAAPKMHTTMCL1
SCHEMBL10933951 0.86 MAPT (0.56) MAPTGAAPKMHTTMCL1
SCHEMBL9095190 0.81 S1PR1 (0.43) MAPTGAAS100BSLC16A3SLC16A1
SCHEMBL81551 0.79 S100B (0.58) MAPTGAAPKMHTTMCL1
SCHEMBL15244176 0.79 S100B (0.64) GAAS100BSLC16A3SLC16A1KDM4E
SCHEMBL19980899 0.79 S100B (0.64) GAAS100BSLC16A3SLC16A1KDM4E
SCHEMBL13422458 0.79 S100B (0.64) GAAS100BSLC16A3SLC16A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1803034-A2 HOLOGRAPHIC STORAGE MEDIUM General Electric Company (US) 2007-07-04 EP disclosed
WO-2006044243-A2 HOLOGRAPHIC STORAGE MEDIUM GENERAL ELECTRIC COMPANY A CORPORATION OF THE STATE OF NEW YORK (US) 2006-04-27 WO disclosed
US-20060078802-A1 Holographic storage medium SABIC INNOVATIVE PLASTICS IP B.V. 2006-04-13 US disclosed
US-4332884-A USING A DIOXIME CHELATING AGENT RICOH CO., LTD. (JP) 1982-06-01 US disclosed
US-4315068-A CONTAINING A COBALT-AMMINE COMPLEX AND A DIOXIME OR A BISIMIDAZOLIN-3-ONE CHELATING AGENT; STABILITY; COLOR DILMS RICOH CO., LTD. (JP) 1982-02-09 US disclosed
US-4306014-A AMMONIA OR AMINES SUPPRESS THE COLOR-FORMING REACTION SYSTEM RICOH CO., LTD. (JP) 1981-12-15 US disclosed