SCHEMBL2453789

SCHEMBL2453789

CCCCCCCCCCCCc1ccc(Oc2ccccc2)cc1.[NaH]

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.61
HTR2A P28223 2/20 0.53
ESR1 P03372 2/20 0.52
ADRA2A P08913 2/20 0.52
ADORA3 P0DMS8 2/20 0.52
TACR2 P21452 2/20 0.52
SLC6A2 P23975 2/20 0.52
SLC6A4 P31645 2/20 0.52
SLC6A3 Q01959 2/20 0.52
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52
LMNA P02545 1/20 0.52
SHBG P04278 1/20 0.52
TP53 P04637 1/20 0.52
CYP3A4 P08684 1/20 0.52
HSPD1 P10809 1/20 0.52
ADRB3 P13945 1/20 0.52
HTR2C P28335 1/20 0.52
HSPE1 P61604 1/20 0.52
HIF1A Q16665 1/20 0.52

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
SCHEMBL10630392 1.00 LTA4H (0.61) LTA4HHTR2AESR1ADRA2AADORA3
SCHEMBL16558294 0.98 LTA4H (0.62) LTA4HHTR2AESR1ADRA2AADORA3
SCHEMBL12721515 0.98 LTA4H (0.62) LTA4HHTR2AESR1ADRA2AADORA3
SCHEMBL4546800 0.98 LTA4H (0.62) LTA4HHTR2AESR1ADRA2AADORA3
SCHEMBL12056748 0.98 LTA4H (0.62) LTA4HHTR2AESR1ADRA2AADORA3
SCHEMBL15312061 0.98 LTA4H (0.62) LTA4HHTR2AESR1ADRA2AADORA3
SCHEMBL5667215 0.96 LTA4H (0.65) LTA4HHTR2AESR1ADRA2AADORA3
Diphenylether SCHEMBL27770101 0.95 LTA4H (0.58) LTA4HHTR2AESR1ADRA2AADORA3
Diphenylether SCHEMBL11580362 0.93 LTA4H (0.59) LTA4HHTR2AESR1ADRA2AADORA3
SCHEMBL1416079 0.93 ESR1 (0.59) HTR2AESR1ADRA2AADORA3TACR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110223540-A1 GUMMING COMPOSITIONS WITH NANO-PARTICLES FOR IMPROVING SCRATCH SENSITIVITY IN IMAGE AND NON-IMAGE AREAS OF LITHOGRAPHIC PRINTING PLATES EASTMAN KODAK COMPANY 2011-09-15 US disclosed
WO-2010066820-A1 NEGATIVE WORKING LITHOGRAPHIC PRINTING PLATE PRECURSORS COMPRISING A REACTIVE BINDER CONTAINING ALIPHATIC BI- OR POLYCYCLIC MOIETIES EASTMAN KODAK COMPANY (US) 2010-06-17 WO disclosed
EP-2196851-A1 Negative working lithographic printing plate precursors comprising a reactive binder containing aliphatic bi- or polycyclic moieties EASTMAN KODAK COMPANY (US) 2010-06-16 EP disclosed
WO-2010063763-A1 GUMMING COMPOSITIONS WITH NANO-PARTICLES FOR IMPROVING SCRATCH SENSITIVITY IN IMAGE AND NON-IMAGE AREAS OF LITHOGRAPHIC PRINTING PLATES EASTMAN KODAK COMPANY (US) 2010-06-10 WO disclosed
US-4154713-A PAPER COATING BINDERS FORSTNER JOSEF (AT) 1979-05-15 US disclosed