SCHEMBL3628183

SCHEMBL3628183

O=C(Sc1ccc(O)cc1)c1ccc(CCl)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.47
CA1 P00915 3/20 0.47
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
LMNA P02545 3/20 0.38
MAPT P10636 2/20 0.38
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
PKM P14618 1/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38
CAMK2A Q9UQM7 1/20 0.37
GFER P55789 2/20 0.36
CYP1A2 P05177 1/20 0.36
GAA P10253 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL1603880 0.85 MAPT (0.50) CA2CA1MEN1KMT2ANPC1
SCHEMBL14437352 0.85 CA1 (0.46) CA2CA1MEN1KMT2ALMNA
SCHEMBL3620902 0.81 MEN1 (0.44) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL10500354 0.80 MAPK1 (0.59) CA2CA1NPC1RAB9ALMNA
SCHEMBL8414299 0.77 LMNA (0.65) CA2CA1MEN1KMT2ANPC1
SCHEMBL10500136 0.77 CES2 (0.45) CA2CA1MEN1KMT2ANPC1
SCHEMBL14599304 0.76 CES2 (0.54) CA2CA1MEN1KMT2ANPC1
SCHEMBL14567121 0.76 CES2 (0.54) CA2CA1MEN1KMT2ANPC1
SCHEMBL537078 0.74
SCHEMBL11657454 0.74 CA1 (0.48) CA2CA1MEN1KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2161255-A1 Phenolic Compound and Recording Material Using the Same NIPPON SODA CO., LTD. (JP) 2010-03-10 EP disclosed
EP-1872131-A4 METHODS OF ENHANCING ISOLATION OF RNA FROM BIOLOGICAL SAMPLES NEXGEN DIAGNOSTICS LLC (US) 2009-04-01 EP disclosed
CN-101107365-A Simplified methods for isolating nucleic acids from cellular materials LUMIGEN INC (US) 2008-01-16 CN disclosed
EP-1872131-A2 METHODS OF ENHANCING ISOLATION OF RNA FROM BIOLOGICAL SAMPLES Nexgen Diagnostics LLC (US) 2008-01-02 EP disclosed
CN-101076603-A Simplified methods for isolating nucleic acids from cellular materials LUMIGEN INC (US) 2007-11-21 CN disclosed
CN-101027411-A Compositions and methods for releasing nucleic acids from solid phase binding materials LUMIGEN INC (US) 2007-08-29 CN disclosed
US-7169737-B2 For use in recording materials using a color developing dye, such as thermal sensitive recording material and pressure sensitive copying material, storage stability NIPPON SODA CO., LTD. (JP) 2007-01-30 US disclosed
WO-2006113198-A2 METHODS OF ENHANCING ISOLATION OF RNA FROM BIOLOGICAL SAMPLES NEXGEN DIAGNOSTICS LLC (US) 2006-10-26 WO disclosed
US-20050096222-A1 For use in recording materials using a color developing dye, such as thermal sensitive recording material and pressure sensitive copying material, storage stability NIPPON SODA CO., LTD. (JP) 2005-05-05 US disclosed