SCHEMBL7563877

SCHEMBL7563877

CCCCC(CCCCCOC(N)=O)OC(N)=O

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.42
HCAR2 Q8TDS4 2/20 0.40
EPHX1 P07099 1/20 0.40
ACHE P22303 6/20 0.39
TSHR P16473 2/20 0.39
CHRNB2 P17787 1/20 0.39
CHRNB4 P30926 1/20 0.39
CHRNA3 P32297 1/20 0.39
CHRNA4 P43681 1/20 0.39
HTR2C P28335 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
PRSS1 P07477 1/20 0.38
PRSS2 P07478 1/20 0.38
PRSS3 P35030 1/20 0.38
ZDHHC7 Q9NXF8 1/20 0.38

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
SCHEMBL7570273 0.93 CHRNB2 (0.39) NAAAHCAR2EPHX1ACHETSHR
SCHEMBL7569676 0.93 CHRNB2 (0.41) NAAAHCAR2ACHETSHRCHRNB2
SCHEMBL7564869 0.88 CHRNB2 (0.40) NAAAHCAR2EPHX1ACHETSHR
SCHEMBL5953699 0.88 CA2 (0.46) CA1CA2ZDHHC7
SCHEMBL4856594 0.88 CA2 (0.46) CA1CA2ZDHHC7
SCHEMBL7564855 0.86 CHRNB2 (0.41) NAAAHCAR2TSHRCHRNB2CHRNB4
SCHEMBL22005296 0.86 GPR84 (0.45) CA2ZDHHC7
SCHEMBL21300541 0.86 GPR84 (0.45) CA2ZDHHC7
SCHEMBL2436142 0.86 GPR84 (0.45) CA2ZDHHC7
SCHEMBL5013944 0.86 GPR84 (0.45) CA2ZDHHC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0855393-B1 BISBENZOTRIAZOLYLPHENOLS OTSUKA KAGAKU KK (JP) 2002-08-14 EP disclosed
US-5922882-A ULTRAVIOLET RADIATION ABSORBER; COPOLYMERIZATION COMPONENT OF BISBENZOTRIAZOLE COMPRISING A COPOLYCARBONATE, A COPOLYESTER, A COPOLYURETHANE AND A COPOLYURETHANEURA OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1999-07-13 US disclosed
EP-0855393-A1 BISBENZOTRIAZOLYLPHENOLS OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1998-07-29 EP disclosed